Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C7H8O |
| Molecular Weight | 108.1381 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
c1ccc(cc1)CO
InChI
InChIKey=WVDDGKGOMKODPV-UHFFFAOYSA-N
InChI=1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2
| Molecular Formula | C7H8O |
| Molecular Weight | 108.1381 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
DescriptionCurator's Comment:: description was created based on several sources, including, http://www.accessdata.fda.gov/drugsatfda_docs/label/2012/022129s005lbl.pdf
Curator's Comment:: description was created based on several sources, including, http://www.accessdata.fda.gov/drugsatfda_docs/label/2012/022129s005lbl.pdf
Benzyl Alcohol is an aromatic alcohol used in a wide variety of cosmetic formulations as a fragrance component, preservative, solvent, and viscosity-decreasing agent. FDA agency approved benzyl alcohol for the treatment of head lice. The drug acts on head lice by inhibiting them from closing their respiratory spiracles, allowing the vehicle to obstruct the spiracles and causing the lice to asphyxiate.
Originator
Approval Year
Cmax
| Value | Dose | Co-administered | Analyte | Population |
|---|---|---|---|---|
1.8 μM EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/27019966/ |
0.46 mmol single, subcutaneous dose: 0.46 mmol route of administration: Subcutaneous experiment type: SINGLE co-administered: NANDROLONE DECANOATE |
BENZOIC ACID serum | Homo sapiens population: HEALTHY age: ADULT sex: FEMALE food status: UNKNOWN |
|
34.8 μM EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/27019966/ |
0.46 mmol single, subcutaneous dose: 0.46 mmol route of administration: Subcutaneous experiment type: SINGLE co-administered: NANDROLONE DECANOATE |
BENZYL ALCOHOL serum | Homo sapiens population: HEALTHY age: ADULT sex: FEMALE food status: UNKNOWN |
|
16.6 μM EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/27019966/ |
0.46 mmol single, subcutaneous dose: 0.46 mmol route of administration: Subcutaneous experiment type: SINGLE co-administered: NANDROLONE DECANOATE |
HIPPURIC ACID serum | Homo sapiens population: HEALTHY age: ADULT sex: FEMALE food status: UNKNOWN |
AUC
| Value | Dose | Co-administered | Analyte | Population |
|---|---|---|---|---|
417.4 μM × h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/27019966/ |
0.46 mmol single, subcutaneous dose: 0.46 mmol route of administration: Subcutaneous experiment type: SINGLE co-administered: NANDROLONE DECANOATE |
BENZOIC ACID serum | Homo sapiens population: HEALTHY age: ADULT sex: FEMALE food status: UNKNOWN |
|
397.3 μM × h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/27019966/ |
0.46 mmol single, subcutaneous dose: 0.46 mmol route of administration: Subcutaneous experiment type: SINGLE co-administered: NANDROLONE DECANOATE |
BENZYL ALCOHOL serum | Homo sapiens population: HEALTHY age: ADULT sex: FEMALE food status: UNKNOWN |
|
7113.6 μM × h EXPERIMENT https://pubmed.ncbi.nlm.nih.gov/27019966/ |
0.46 mmol single, subcutaneous dose: 0.46 mmol route of administration: Subcutaneous experiment type: SINGLE co-administered: NANDROLONE DECANOATE |
HIPPURIC ACID serum | Homo sapiens population: HEALTHY age: ADULT sex: FEMALE food status: UNKNOWN |
Doses
| Dose | Population | Adverse events |
|---|---|---|
234 mg/kg multiple, intravenous Overdose Dose: 234 mg/kg Route: intravenous Route: multiple Dose: 234 mg/kg Sources: |
unhealthy, 29 weeks (range: 26-34 weeks) n = 10 Health Status: unhealthy Condition: gasping syndrome Age Group: 29 weeks (range: 26-34 weeks) Population Size: 10 Sources: |
Disc. AE: Toxic reaction (NOS)... AEs leading to discontinuation/dose reduction: Toxic reaction (NOS) (grade 5, 2 patients) Sources: |
AEs
| AE | Significance | Dose | Population |
|---|---|---|---|
| Toxic reaction (NOS) | grade 5, 2 patients Disc. AE |
234 mg/kg multiple, intravenous Overdose Dose: 234 mg/kg Route: intravenous Route: multiple Dose: 234 mg/kg Sources: |
unhealthy, 29 weeks (range: 26-34 weeks) n = 10 Health Status: unhealthy Condition: gasping syndrome Age Group: 29 weeks (range: 26-34 weeks) Population Size: 10 Sources: |
PubMed
| Title | Date | PubMed |
|---|---|---|
| Isolation and characterization of a pseudomonas strain that degrades 4-acetamidophenol and 4-aminophenol. | 2001 |
|
| Final report on the safety assessment of Benzyl Alcohol, Benzoic Acid, and Sodium Benzoate. | 2001 |
|
| Bilirubin-albumin binding and free bilirubin. | 2001 Dec |
|
| Wound healing activity of human placental extracts in rats. | 2001 Dec |
|
| Competitive binding of aroma compounds by beta-cyclodextrin. | 2001 Dec |
|
| Isolated mental developmental delay in very low birth weight infants: association with prolonged doxapram therapy for apnea. | 2001 Dec |
|
| Mechanism of cytochrome P4503A4- and 2D6-catalyzed dehydrogenation of ezlopitant as probed with isotope effects using five deuterated analogs. | 2001 Dec |
|
| Benzylidene analogs of anabaseine display partial agonist and antagonist properties at the mouse 5-hydroxytryptamine(3A) receptor. | 2001 Dec |
|
| Inhibition of malonaldehyde formation from blood plasma oxidation by aroma extracts and aroma components isolated from clove and eucalyptus. | 2001 Dec |
|
| Assembly of a robust, thermally stable porous cobalt(II) nicotinate framework based on a dicobalt carboxylate unit. | 2001 Dec 3 |
|
| A novel, tunable manganese coordination system based on a flexible "spacer" unit: noncovalent templation effects. | 2001 Dec 5 |
|
| Dynamic structures of horse liver alcohol dehydrogenase (HLADH): results of molecular dynamics simulations of HLADH-NAD(+)-PhCH(2)OH, HLADH-NAD(+)-PhCH(2)O(-), and HLADH-NADH-PhCHO. | 2001 Dec 5 |
|
| Benzyl alcohol with epinephrine as an alternative to lidocaine with epinephrine. | 2001 Nov |
|
| A concise total synthesis of the azaphenanthrene alkaloid eupolauramine. | 2001 Nov 30 |
|
| Biotransformation of benzaldehyde into (R)-phenylacetylcarbinol by filamentous fungi or their extracts. | 2001 Oct |
|
| Volatiles from Ficus hispida and their attractiveness to fig wasps. | 2001 Oct |
|
| Metabolism and disposition of the novel antileukaemic drug, benzamide riboside, in the isolated perfused rat liver. | 2001 Oct 12 |
|
| Pharmacodynamics of intravenous and subcutaneous tinzaparin and heparin in healthy volunteers. | 2001 Sep 1 |
|
| Redox chemistry of morpholine-based Os(VI)-hydrazido complexes: trans-[Os(VI)(tpy)(Cl)2(NN(CH2)4O)](2+). | 2001 Sep 24 |
|
| Susceptibility to the ototoxic properties of toluene is species specific. | 2002 Apr |
|
| Characterization of paint samples used in drinking water reservoirs: identification of endocrine disruptor compounds. | 2002 Apr |
|
| The depth of porphyrin in a membrane and the membrane's physical properties affect the photosensitizing efficiency. | 2002 Apr |
|
| An MCASE approach to the search of a cure for Parkinson's Disease. | 2002 Apr 2 |
|
| Composition of the volatiles from intact and mechanically pierced tea aphid-tea shoot complexes and their attraction to natural enemies of the tea aphid. | 2002 Apr 24 |
|
| Identification of a protein-promoting vibration in the reaction catalyzed by horse liver alcohol dehydrogenase. | 2002 Apr 3 |
|
| Preparation of soluble and insoluble polymer supported IBX reagents. | 2002 Aug 5 |
|
| The discovery of PD 89211 and related compounds: selective dopamine D4 receptor antagonists. | 2002 Feb |
|
| The effect of the nature of H-bonding groups on diffusion through PDMS membranes saturated with octanol and toluene. | 2002 Feb |
|
| Physico-chemical properties and degradability of non-woven hyaluronan benzylic esters as tissue engineering scaffolds. | 2002 Feb |
|
| Rate sensitivity of shear-induced changes in the lateral diffusion of endothelial cell membrane lipids: a role for membrane perturbation in shear-induced MAPK activation. | 2002 Feb |
|
| Sorption of benzoic acid, sorbic acid, benzyl alcohol, and benzalkonium chloride by flexible tubing. | 2002 Jan |
|
| Disposition of 1-[3-(aminomethyl)phenyl]-N-[3-fluoro-2'- (methylsulfonyl)-[1,1'-biphenyl]-4-yl]-3-(trifluoromethyl)- 1H-pyrazole-5-carboxamide (DPC 423) by novel metabolic pathways. Characterization of unusual metabolites by liquid chromatography/mass spectrometry and NMR. | 2002 Jan |
|
| The ability of various chemicals to elicit olfactory beta-waves in the pyriform cortex of meadow voles (Microtus pennsylvanicus) and laboratory rats (Rattus norvegicus). | 2002 Jan 11 |
|
| The deprotonation of benzyl alcohol radical cations: a mechanistic dichotomy in the gas phase as in solution. | 2002 Jan 18 |
|
| Flash photolytic generation of o-quinone alpha-phenylmethide and o-quinone alpha-(p-anisyl)methide in aqueous solution and investigation of their reactions in that medium. Saturation of acid-catalyzed hydration. | 2002 Jan 30 |
|
| Effects of butylated hydroxyanisole and butylated hydroxytoluene on DNA adduct formation and arylamine N-acetyltransferase activity in human bladder tumour cells. | 2002 Jan-Feb |
|
| Mineralization of aromatic compounds by brown-rot basidiomycetes - mechanisms involved in initial attack on the aromatic ring. | 2002 Jun |
|
| A new amperometric enzyme electrode for alcohol determination. | 2002 Jun |
|
| SAR and species/stereo-selective metabolism of the sorbitol dehydrogenase inhibitor, CP-470,711. | 2002 Jun 3 |
|
| Investigation of polymeric nanoparticles as carriers of enalaprilat for oral administration. | 2002 Jun 4 |
|
| Microwave-driven zeolite-guest systems show athermal effects from nonequilibrium molecular dynamics. | 2002 Jun 5 |
|
| Volatiles from rhizomes of Rhodiola rosea L. | 2002 Mar |
|
| Hydroxy-substituted oligopyridine dicarboxamide helical foldamers. | 2002 Mar 21 |
|
| Copper-catalyzed coupling of aryl iodides with aliphatic alcohols. | 2002 Mar 21 |
|
| Yeast-mediated preparation of l-PAC in an organic solvent. | 2002 Mar 30 |
|
| Catalytic degradation of CH2O and C6H5CH2OH in wastewaters. | 2002 May |
|
| Comparison of the antioxidant properties of HYAFF-11p75, AQUACEL and hyaluronan towards reactive oxygen species in vitro. | 2002 May |
|
| Essential oil constituents and in vitro antimicrobial activity of Decalepis hamiltonii roots against foodborne pathogens. | 2002 May 22 |
|
| The mediation of veratryl alcohol in oxidations promoted by lignin peroxidase: the lifetime of veratryl alcohol radical cation. | 2002 May 3 |
|
| Diastereoselective reactions of delta-oxy-substituted allylic acetates with organocopper reagents. | 2002 May 3 |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Jun 25 21:16:22 UTC 2021
by
admin
on
Fri Jun 25 21:16:22 UTC 2021
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| Record UNII |
LKG8494WBH
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| Record Status |
Validated (UNII)
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| Record Version |
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| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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JECFA EVALUATION |
BENZYL ALCOHOL
Created by
admin on Fri Jun 25 21:16:22 UTC 2021 , Edited by admin on Fri Jun 25 21:16:22 UTC 2021
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NCI_THESAURUS |
C28394
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NDF-RT |
N0000181811
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JECFA EVALUATION |
INS-1519
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EC SCIENTIFIC COMMITTEE ON CONSUMER SAFETY OPINION |
SCCS/1459/11
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EPA PESTICIDE CODE |
9502
Created by
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WHO-ATC |
P03AX06
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CFR |
21 CFR 172.515
Created by
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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BENZYL ALCOHOL
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PRIMARY | |||
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100-51-6
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PRIMARY | |||
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C77028
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PRIMARY | |||
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M2397
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PRIMARY | Merck Index | ||
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202-859-9
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PRIMARY | |||
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BENZYL ALCOHOL
Created by
admin on Fri Jun 25 21:16:22 UTC 2021 , Edited by admin on Fri Jun 25 21:16:22 UTC 2021
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PRIMARY | Description: A clear, colourless, oily liquid; odour, slightly aromatic. Solubility: Soluble in water; miscible with ethanol (~750 g/l) TS, ether R, fatty and essential oils. Category: Antimicrobial preservative. Storage: Benzyl alcohol should be kept in a tightly closed container, protected from light. Additional information: Benzyl alcohol is affected by air and light, and should be protected from exposure to excessive heat. | ||
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100-51-6
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PRIMARY | |||
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CHEMBL720
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DB06770
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SUB05771MIG
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334
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45
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1061901
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PRIMARY | USP-RS | ||
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D019905
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923
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1426
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PRIMARY | RxNorm | ||
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244
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LKG8494WBH
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
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IMPURITY -> PARENT |
| Related Record | Type | Details | ||
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ACTIVE MOIETY |
http://apps.who.int/phint/pdf/b/Jb.6.1.50.pdf
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