EU/US Properties Organoleptics Cosmetics Suppliers Safety Safety in use Safety references References Other Blenders Uses Occurrence Synonyms Articles Notes
 

(S)-(+)-2-hexanol
(S)-2-hexanol

Supplier Sponsors

CAS Number: 52019-78-0Picture of molecule3D/inchi
Nikkaji Web:J59.052E
Beilstein Number:1718997
MDL:MFCD00065955
XlogP:1.90 (est)
Molecular Weight:102.17678000
Formula:C6 H14 O
NMR Predictor:Predict (works with chrome or firefox)
Category:flavoring agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar:Search
Google Books:Search
Google Scholar: with word "volatile"Search
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Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
PubMed:Search
NCBI:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.81800 @ 25.00 °C.
Boiling Point: 139.00 to 170.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure:2.634000 mmHg @ 25.00 °C. (est)
Flash Point: 124.00 °F. TCC ( 51.00 °C. )
logP (o/w): 1.754 (est)
Soluble in:
 alcohol
 water, 1.171e+004 mg/L @ 25 °C (est)
Insoluble in:
 water
 
Organoleptic Properties:
Odor Type: earthy
Odor Strength:medium
mushroom green ripe berry astringent metallic
Odor Description:at 100.00 %. mushroom green ripe berry astringent metallic
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
(S)-hexan-2-ol
Santa Cruz Biotechnology
For experimental / research use only.
(S)-(+)-2-Hexanol
Sigma-Aldrich: Aldrich
For experimental / research use only.
(S)-(+)-2-Hexanol 98%
 
Safety Information:
Preferred SDS: View
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
 
Safety in Use Information:
Category:
flavoring agents
Recommendation for (S)-(+)-2-hexanol usage levels up to:
 not for fragrance use.
 
 
Safety References:
EPI System: View
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :638097
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 1992
WGK Germany:3
(2S)-hexan-2-ol
Chemidplus:0052019780
 
References:
Leffingwell:Chirality or Article
 (2S)-hexan-2-ol
NIST Chemistry WebBook:Search Inchi
Pubchem (cid):638097
Pubchem (sid):135101580
 
Other Information:
(IUPAC):Atomic Weights of the Elements 2011 (pdf)
Videos:The Periodic Table of Videos
tgsc:Atomic Weights use for this web site
(IUPAC):Periodic Table of the Elements
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2905.19.0020
VCF-Online:VCF Volatile Compounds in Food
ChemSpider:View
 
Potential Blenders and core components note
For Odor
earthy
benzyl tiglate
FL/FR
fatty
(E)-2-
decenal
FL/FR
floral
2-
phenyl propionaldehyde dimethyl acetal
FL/FR
fruity
berry pentadienoate
FL/FR
ethyl 2-methyl butyrate
FL/FR
ethyl valerate
FL/FR
2-
methyl butyl 2-methyl butyrate
FL/FR
green
melon acetal
FL/FR
herbal
artemisyl ketone
FL/FR
mushroom
3-
octen-2-ol
FL/FR
For Flavor
No flavor group found for these
artemisyl ketone
FL/FR
benzyl tiglate
FL/FR
fruity
fruity
berry pentadienoate
FL/FR
ethyl 2-methyl butyrate
FL/FR
ethyl valerate
FL/FR
2-
methyl butyl 2-methyl butyrate
FL/FR
2-
phenyl propionaldehyde dimethyl acetal
FL/FR
green
melon acetal
FL/FR
mushroom
3-
octen-2-ol
FL/FR
waxy
(E)-2-
decenal
FL/FR
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 found in nature
 
Synonyms:
(2S)-hexan-2-ol
(S)-2-hexanol
(S)(+)-2-hexanol
S-(+)-2-hexanol
2-hexanol, (2S)-
2-hexanol, (S)-
 
 
Notes:
None found
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