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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 1,2-HEXANEDIOL

SMILES

CCCCC(O)CO

InChI

InChIKey=FHKSXSQHXQEMOK-UHFFFAOYSA-N
InChI=1S/C6H14O2/c1-2-3-4-6(8)5-7/h6-8H,2-5H2,1H3

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 ( + / - )

1,2-Hexanediol is widely used in various cosmetic applications such as hair conditioners, deodorants and antiperspirants. It is involved in the modification of sodium dodecyl sulfate micelles, which is used for amino acid separation by micellar electrokinetic chromatography method. It is a moisturizing agent and plays a vital role in baby care products, bath products, eye makeup, cleansing products and skin care products. It is also used as an additive in liquid cleaning compositions. Acute and chronic toxicities of 1,2-Hexanediol were generally lower than those of methylparaben. The antimicrobial activity of 1,2-Hexanediol against Gram-positive and Gram-negative bacteria was potentiated with food-grade antimicrobials including xanthorrhizol, macelignan, panduratin A and octyl gallate, which have already been reported to display anti-inflammatory and other beneficial activities related to cosmetics. Therefore, the combination of 1,2-Hexanediol and these food-grade antimicrobial agents would have benefits not only for increasing the antimicrobial activity but also in cosmetics use.

Approval Year

PubMed

PubMed

TitleDatePubMed
The efficiency of humectants as skin moisturizers in the presence of oil.
2001 Feb
Inhibition of N-methyl-D-aspartate receptors by straight-chain diols: implications for the mechanism of the alcohol cutoff effect.
2002 Jan
[Coprecipitation of the Pseudomonas fluorescens lipase with hydrophobic compounds as an approach to its immobilization for catalysis in nonaqueous media].
2002 Jan-Feb
Organic modifiers for the separation of organic acids and bases by liquid chromatography.
2002 Jul 26
Profiling isoflavonoids found in legume root extracts using capillary electrophoresis.
2002 Jun
Stereoselective oxidation of aliphatic diols and reduction of hydroxy-ketones with galactitol dehydrogenase from Rhodobacter sphaeroides D.
2003
Heat capacity studies of formation of micelle-like structure in aqueous solutions of some alkane polyols.
2003 Jan 15
Influence of ion pairing on topical delivery of retinoic acid from microemulsions.
2003 Jan 17
Purification, characterization, and gene cloning of glycerol dehydrogenase from Hansenula ofunaensis, and its expression for production of optically active diol.
2006 Dec
Positively charged microemulsions for topical application.
2008 Jan 4
Safety of a preservative system containing 1,2-hexanediol and caprylyl glycol.
2009
Modification of galactitol dehydrogenase from Rhodobacter sphaeroides D for immobilization on polycrystalline gold surfaces.
2009 Oct 20
Acid-, water- and high-temperature-stable ruthenium complexes for the total catalytic deoxygenation of glycerol to propane.
2009 Oct 5
Modification of a micellar system for amino acid separation by MEKC--application for amino acid profiling in formulations for parenteral use.
2010 Dec 15
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:14:18 UTC 2023
Edited
by admin
on Fri Dec 15 19:14:18 UTC 2023
Record UNII
TR046Y3K1G
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2-HEXANEDIOL
INCI  
INCI  
Official Name English
1,2-HEXANEDIOL [INCI]
Common Name English
1,2-HEXANEDIOL, DL
Common Name English
1,2-DIHYDROXYHEXANE
Systematic Name English
DL-1,2-HEXANEDIOL
Common Name English
Code System Code Type Description
DAILYMED
TR046Y3K1G
Created by admin on Fri Dec 15 19:14:18 UTC 2023 , Edited by admin on Fri Dec 15 19:14:18 UTC 2023
PRIMARY
FDA UNII
TR046Y3K1G
Created by admin on Fri Dec 15 19:14:18 UTC 2023 , Edited by admin on Fri Dec 15 19:14:18 UTC 2023
PRIMARY
EVMPD
SUB179561
Created by admin on Fri Dec 15 19:14:18 UTC 2023 , Edited by admin on Fri Dec 15 19:14:18 UTC 2023
PRIMARY
DRUG BANK
DB14108
Created by admin on Fri Dec 15 19:14:18 UTC 2023 , Edited by admin on Fri Dec 15 19:14:18 UTC 2023
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SMS_ID
100000164927
Created by admin on Fri Dec 15 19:14:18 UTC 2023 , Edited by admin on Fri Dec 15 19:14:18 UTC 2023
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PUBCHEM
94335
Created by admin on Fri Dec 15 19:14:18 UTC 2023 , Edited by admin on Fri Dec 15 19:14:18 UTC 2023
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EPA CompTox
DTXSID40863959
Created by admin on Fri Dec 15 19:14:18 UTC 2023 , Edited by admin on Fri Dec 15 19:14:18 UTC 2023
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RXCUI
1362584
Created by admin on Fri Dec 15 19:14:18 UTC 2023 , Edited by admin on Fri Dec 15 19:14:18 UTC 2023
PRIMARY RxNorm
ECHA (EC/EINECS)
230-029-6
Created by admin on Fri Dec 15 19:14:18 UTC 2023 , Edited by admin on Fri Dec 15 19:14:18 UTC 2023
PRIMARY
CAS
6920-22-5
Created by admin on Fri Dec 15 19:14:18 UTC 2023 , Edited by admin on Fri Dec 15 19:14:18 UTC 2023
PRIMARY