U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C6H14O2
Molecular Weight 118.1742
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEXYLENE GLYCOL

SMILES

CC(O)CC(C)(C)O

InChI

InChIKey=SVTBMSDMJJWYQN-UHFFFAOYSA-N
InChI=1S/C6H14O2/c1-5(7)4-6(2,3)8/h5,7-8H,4H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C6H14O2
Molecular Weight 118.1742
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Hexylene glycol is a small molecular weight surfactant. Hexylene Glycol is a solvent and viscosity agent used in many skin care products. Hexylene Glycol is a solvent and viscosity agent used in many skin care products. It is used to thin out heavy compositions and create a thinner, more spreadable product. Hexylene Glycol is a solvent and viscosity agent used in many skin care products. Hexylene glycol is used in the formulation of hair and bath products, eye and facial makeup, fragrances, personal cleanliness products, and shaving and skin care products. Hexylene glycol is widely used in the coating industry as a component for lacquers, varnishes, printing inks and both oil and water-based paints. Although the FDA has approved Hexylene Glycol and the CIR found it an acceptable solvent in skin care products, some studies have shown that it is an irritant.

Approval Year

Conditions

Conditions

ConditionModalityTargetsHighest PhaseProduct
Inactive ingredient
HERBALIFE SKIN 7 DAY RESULTS KIT

Approved Use

Helps prevent sunburn. If used as directed with other sun protection measures, decreases the risk of skin cancer and early skin aging caused by the sun.
PubMed

PubMed

TitleDatePubMed
Crystallization and preliminary X-ray analysis of a marine diatom-infecting single-stranded RNA virus.
2010-11-01
Implications for collagen binding from the crystallographic structure of fibronectin 6FnI1-2FnII7FnI.
2010-10-29
Structural basis for cyclic Py-Im polyamide allosteric inhibition of nuclear receptor binding.
2010-10-20
Regulation of response regulator autophosphorylation through interdomain contacts.
2010-10-15
Structural insights into serine-rich fimbriae from Gram-positive bacteria.
2010-10-15
Structure of a membrane-attack complex/perforin (MACPF) family protein from the human gut symbiont Bacteroides thetaiotaomicron.
2010-10-01
Open and closed conformations of two SpoIIAA-like proteins (YP_749275.1 and YP_001095227.1) provide insights into membrane association and ligand binding.
2010-10-01
Structure of an essential bacterial protein YeaZ (TM0874) from Thermotoga maritima at 2.5 Å resolution.
2010-10-01
PagP crystallized from SDS/cosolvent reveals the route for phospholipid access to the hydrocarbon ruler.
2010-09-08
A new crystal form of Lys48-linked diubiquitin.
2010-09-01
Molecular basis for defect in Alix-binding by alternatively spliced isoform of ALG-2 (ALG-2DeltaGF122) and structural roles of F122 in target recognition.
2010-08-06
Crystallisation of wild-type and variant forms of a recombinant plant enzyme β-D-glucan glucohydrolase from barley (Hordeum vulgare L.) and preliminary X-ray analysis.
2010-07-19
X-ray analysis of bilirubin oxidase from Myrothecium verrucaria at 2.3 A resolution using a twinned crystal.
2010-07-01
Structure of Arabidopsis chloroplastic monothiol glutaredoxin AtGRXcp.
2010-06
Crystal structure of 1-deoxy-d-xylulose 5-phosphate reductoisomerase from the hyperthermophile Thermotoga maritima for insights into the coordination of conformational changes and an inhibitor binding.
2010-06
X-ray structures of Bacillus pallidus d-arabinose isomerase and its complex with l-fucitol.
2010-06
Progress in rational methods of cryoprotection in macromolecular crystallography.
2010-04
The X-ray crystal structure of Escherichia coli succinic semialdehyde dehydrogenase; structural insights into NADP+/enzyme interactions.
2010-02-18
Bacterial pleckstrin homology domains: a prokaryotic origin for the PH domain.
2010-02-12
Structural determination of functional units of the nucleotide binding domain (NBD94) of the reticulocyte binding protein Py235 of Plasmodium yoelii.
2010-02-10
A constitutively active and uninhibitable caspase-3 zymogen efficiently induces apoptosis.
2009-12-10
Purification, crystallization and preliminary X-ray analysis of a deletion mutant of a major buckwheat allergen.
2009-12-01
Interpreting a low resolution map of human U1 snRNP using anomalous scatterers.
2009-07-15
Substrate binding in the FAD-dependent hydroxynitrile lyase from almond provides insight into the mechanism of cyanohydrin formation and explains the absence of dehydrogenation activity.
2009-04-21
Tryptophan as a three-way switch in regulating the function of the secretory signalling glycoprotein (SPS-40) from mammary glands: structure of SPS-40 complexed with 2-methylpentane-2,4-diol at 1.6 A resolution.
2009-04
Crystallization and preliminary X-ray diffraction analysis of a complex between the electron-transfer partners hexameric Cu-containing nitrite reductase and pseudoazurin.
2009-02-01
Substrate binding induces structural changes in cytochrome P450cam.
2009-02-01
Snapshots of catalysis in the E1 subunit of the pyruvate dehydrogenase multienzyme complex.
2008-12-10
Crystal structure of a sulfur carrier protein complex found in the cysteine biosynthetic pathway of Mycobacterium tuberculosis.
2008-09-30
Formylglycinamide ribonucleotide amidotransferase from Thermotoga maritima: structural insights into complex formation.
2008-07-29
Duplex structure of a minimal nucleic acid.
2008-07-02
Protecting role of cosolvents in protein denaturation by SDS: a structural study.
2008-06-03
Characterization of Aquifex aeolicus 4-diphosphocytidyl-2C-methyl-d-erythritol kinase - ligand recognition in a template for antimicrobial drug discovery.
2008-06
Structure of the Drosophila nucleosome core particle highlights evolutionary constraints on the H2A-H2B histone dimer.
2008-04
Mapping of immunogenic and protein-interacting regions at the surface of the seven-bladed beta-propeller domain of the HIV-1 cellular interactor EED.
2008-02-27
Refolding SDS-denatured proteins by the addition of amphipathic cosolvents.
2008-02-01
Structures of the signal recognition particle receptor from the archaeon Pyrococcus furiosus: implications for the targeting step at the membrane.
2008
DNA conformational effects on the interaction of netropsin with A-tract sequences.
2007-12-25
Crystallization, data collection and processing of the chymotrypsin-BTCI-trypsin ternary complex.
2007-12-01
Aqueous self-assembly of phytantriol in ternary systems: effect of monoolein, distearoylphosphatidylglycerol and three water-miscible solvents.
2007-11-15
Crystallization and preliminary X-ray crystallographic study of [NiFe]-hydrogenase maturation factor HypE from Thermococcus kodakaraensis KOD1.
2007-09-01
The structures of transcription factor CGL2947 from Corynebacterium glutamicum in two crystal forms: a novel homodimer assembling and the implication for effector-binding mode.
2007-09
Overexpression, purification, crystallization and preliminary structural studies of catabolic ornithine transcarbamylase from Lactobacillus hilgardii.
2007-07-01
Structure of the ThDP-dependent enzyme benzaldehyde lyase refined to 1.65 A resolution.
2007-07-01
Preliminary crystallographic analysis of L-2-keto-3-deoxyarabonate dehydratase, an enzyme involved in an alternative bacterial pathway of L-arabinose metabolism.
2007-05-01
In silico prediction of SARS protease inhibitors by virtual high throughput screening.
2007-04
Purification, crystallization and preliminary crystallographic analysis of the putative thiamine-biosynthesis protein PH1313 from Pyrococcus horikoshii OT3.
2007-01-01
Crystallization and preliminary X-ray diffraction studies of a hyperthermophilic Rieske protein variant (SDX-triple) with an engineered rubredoxin-like mononuclear iron site.
2006-10-01
Structure of Bacillus halmapalus alpha-amylase crystallized with and without the substrate analogue acarbose and maltose.
2006-09-01
Trypanosoma brucei UDP-galactose-4'-epimerase in ternary complex with NAD+ and the substrate analogue UDP-4-deoxy-4-fluoro-alpha-D-galactose.
2006-09-01
Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:23:43 GMT 2025
Edited
by admin
on Mon Mar 31 18:23:43 GMT 2025
Record UNII
KEH0A3F75J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEXYLENE GLYCOL
HSDB   II   INCI   MART.   MI   USP-RS  
INCI  
Official Name English
NSC-8098
Preferred Name English
HEXYLENE GLYCOL [USP-RS]
Common Name English
HEXYLENE GLYCOL [MI]
Common Name English
2-Methyl-2,4-pentanediol
Systematic Name English
HEXYLENE GLYCOL [HSDB]
Common Name English
HEXYLENE GLYCOL [MART.]
Common Name English
2,4-PENTANEDIOL, 2-METHYL-
Systematic Name English
HEXYLENE GLYCOL [II]
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 68601
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
Code System Code Type Description
RS_ITEM_NUM
1308200
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
HSDB
1126
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
CAS
107-41-5
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
ECHA (EC/EINECS)
203-489-0
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
DAILYMED
KEH0A3F75J
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
EVMPD
SUB28776
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
CHEBI
62995
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
NSC
8098
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
FDA UNII
KEH0A3F75J
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
NCI_THESAURUS
C77469
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
MESH
C011480
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
SMS_ID
100000092284
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
EPA CompTox
DTXSID5021885
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
PUBCHEM
7870
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
ChEMBL
CHEMBL2104293
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY
NCI_THESAURUS
C45678
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
CONCEPT Industrial Aid
RXCUI
1305548
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY RxNorm
MERCK INDEX
m6016
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY Merck Index
WIKIPEDIA
2-METHYL-2,4-PENTANEDIOL
Created by admin on Mon Mar 31 18:23:43 GMT 2025 , Edited by admin on Mon Mar 31 18:23:43 GMT 2025
PRIMARY