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Details

Stereochemistry ACHIRAL
Molecular Formula C8H10O
Molecular Weight 122.1644
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-METHYLBENZYL ALCOHOL

SMILES

CC1=CC=C(CO)C=C1

InChI

InChIKey=KMTDMTZBNYGUNX-UHFFFAOYSA-N
InChI=1S/C8H10O/c1-7-2-4-8(6-9)5-3-7/h2-5,9H,6H2,1H3

HIDE SMILES / InChI

Molecular Formula C8H10O
Molecular Weight 122.1644
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
The use of computational QSAR analysis in the toxicological evaluation of a series of 2-pyridylcarboxamidrazone candidate anti-tuberculosis compounds.
2003 Jun
Androgen conversion in osteoarthritis and rheumatoid arthritis synoviocytes--androstenedione and testosterone inhibit estrogen formation and favor production of more potent 5alpha-reduced androgens.
2005
Control of stripelike and hexagonal self-assembly of gold nanoparticles by the tuning of interactions between triphenylene ligands.
2007 Nov 21
Synthesis, characterization, and theory of [9]-, [12]-, and [18]cycloparaphenylene: carbon nanohoop structures.
2008 Dec 31
Size-restricted proton transfer within toluene-methanol cluster ions.
2008 Nov 20
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:11:11 GMT 2023
Edited
by admin
on Fri Dec 15 18:11:11 GMT 2023
Record UNII
EXZ915A627
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-METHYLBENZYL ALCOHOL
HSDB  
Systematic Name English
P-TOLYLMETHANOL
Common Name English
(4-TOLYL)METHANOL
Systematic Name English
P-TOLUALCOHOL
Common Name English
P-TOLUYL ALCOHOL
Common Name English
BENZENEMETHANOL, 4-METHYL-
Systematic Name English
BENZYL ALCOHOL, P-METHYL-
Common Name English
NSC-3992
Code English
FEMA NO. 4624
Code English
P-TOLYLCARBINOL
Common Name English
METHYL BENZYL ALCOHOL, P-
Common Name English
P-TOLUIC ALCOHOL
Common Name English
4-(HYDROXYMETHYL)TOLUENE
Systematic Name English
4-METHYLBENZYL ALCOHOL [HSDB]
Common Name English
Classification Tree Code System Code
JECFA EVALUATION 4-METHYLBENZYL ALCOHOL
Created by admin on Fri Dec 15 18:11:11 GMT 2023 , Edited by admin on Fri Dec 15 18:11:11 GMT 2023
Code System Code Type Description
NSC
3992
Created by admin on Fri Dec 15 18:11:11 GMT 2023 , Edited by admin on Fri Dec 15 18:11:11 GMT 2023
PRIMARY
PUBCHEM
11505
Created by admin on Fri Dec 15 18:11:11 GMT 2023 , Edited by admin on Fri Dec 15 18:11:11 GMT 2023
PRIMARY
FDA UNII
EXZ915A627
Created by admin on Fri Dec 15 18:11:11 GMT 2023 , Edited by admin on Fri Dec 15 18:11:11 GMT 2023
PRIMARY
HSDB
7615
Created by admin on Fri Dec 15 18:11:11 GMT 2023 , Edited by admin on Fri Dec 15 18:11:11 GMT 2023
PRIMARY
CAS
589-18-4
Created by admin on Fri Dec 15 18:11:11 GMT 2023 , Edited by admin on Fri Dec 15 18:11:11 GMT 2023
PRIMARY
ECHA (EC/EINECS)
209-639-1
Created by admin on Fri Dec 15 18:11:11 GMT 2023 , Edited by admin on Fri Dec 15 18:11:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID5025574
Created by admin on Fri Dec 15 18:11:11 GMT 2023 , Edited by admin on Fri Dec 15 18:11:11 GMT 2023
PRIMARY
JECFA MONOGRAPH
2042
Created by admin on Fri Dec 15 18:11:11 GMT 2023 , Edited by admin on Fri Dec 15 18:11:11 GMT 2023
PRIMARY
CHEBI
1895
Created by admin on Fri Dec 15 18:11:11 GMT 2023 , Edited by admin on Fri Dec 15 18:11:11 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> METABOLITE