methoxyhexane thiol
3-hexanethiol, 1-methoxy-
 
Notes:
None found
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1-methoxyhexane-3-thiol (Click)
CAS Number: 94291-50-6Picture of molecule
ECHA EINECS - REACH Pre-Reg: 304-874-7
Nikkaji Web: J326.425D
XlogP3-AA: 2.00 (est)
Molecular Weight: 148.26872000
Formula: C7 H16 O S
NMR Predictor: Predict (works with chrome or firefox)
Category: fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 184.00 to  185.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.155000 mm/Hg @ 25.00 °C. (est)
Flash Point: 171.00 °F. TCC ( 77.10 °C. ) (est)
logP (o/w): 1.703 (est)
Soluble in:
 alcohol
 water, 698.7 mg/L @ 25 °C (est)
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Organoleptic Properties:
Odor Description:
herbal
  
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Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
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Suppliers:
Aston Chemical
For experimental / research use only.
1-Methoxyhexane-3-thiol
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Safety Information:
 
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
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Safety in Use Information:
Category: fragrance agents
 
Recommendation for methoxyhexane thiol flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 3024273
National Institute of Allergy and Infectious Diseases: Data
 1-methoxyhexane-3-thiol
Chemidplus: 0094291506
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References:
Leffingwell: chirality
 1-methoxyhexane-3-thiol
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 94291-50-6
Pubchem (cid): 3024273
Pubchem (sid): 135217347
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Other Information:
(IUPAC): Atomic Weights of the Elements 2009
(IUPAC): Atomic Weights of the Elements 2009 (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
ChemSpider: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
3-hexanethiol, 1-methoxy-
1-methoxy-3-hexane thiol
1-methoxy-3-hexanethiol
1-methoxyhexane-3-thiol
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Articles:
 None found yet.
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