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cyclohexyl mercaptan
mercaptocyclohexane

Supplier Sponsors

Name:cyclohexanethiol
CAS Number: 1569-69-3Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg:216-378-7
FDA UNII:N8HOD9900V
Nikkaji Web:J13.114H
Beilstein Number:1236342
MDL:MFCD00001455
CoE Number:529
XlogP3-AA:2.70 (est)
Molecular Weight:116.22664000
Formula:C6 H12 S
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
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist:Search
Google Patents:Search
US Patents:Search
EU Patents:Search
Pubchem Patents:Search
 
Physical Properties:
Appearance:colorless clear liquid (est)
Assay: 97.00 to 100.00
Food Chemicals Codex Listed: No
Specific Gravity:0.95000 to 0.98000 @ 25.00 °C.
Pounds per Gallon - (est).: 7.905 to 8.155
Refractive Index:1.49300 @ 20.00 °C.
Melting Point:-118.00 °C. @ 760.00 mm Hg
Boiling Point: 157.00 to 159.00 °C. @ 760.00 mm Hg
Vapor Pressure:1.300000 mm/Hg @ 20.00 °C.
Vapor Density:4.0 ( Air = 1 )
Flash Point: 109.00 °F. TCC ( 42.78 °C. )
logP (o/w): 2.904 (est)
Soluble in:
 alcohol
 water, 259.5 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
Odor Description:sulfurous
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
Endeavour Specialty Chemicals
Cyclohexanethiol
Speciality Chemical Product Groups
Penta International
CYCLOHEXANETHIOL
Santa Cruz Biotechnology
For experimental / research use only.
Cyclohexanethiol
Sigma-Aldrich: Aldrich
For experimental / research use only.
Cyclohexanethiol 97%
 
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xn - Harmful.
R 10 - Flammable.
R 20/22 - Harmful by inhalation and if swallowed.
S 02 - Keep out of the reach of children.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.
 
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 cyclohexyl mercaptan usage levels up to:
 not for fragrance use.
 
 
Safety References:
EPI System: View
NIOSH International Chemical Safety Cards:search
NIOSH Pocket Guide:search
NLM Hazardous Substances Data Bank:Search
EPA Substance Registry Services (TSCA):1569-69-3
EPA ACToR:Toxicology Data
EPA Substance Registry Services (SRS):Registry
Laboratory Chemical Safety Summary :15290
National Institute of Allergy and Infectious Diseases:Data
WISER:UN 3054
WGK Germany:3
cyclohexanethiol
Chemidplus:0001569693
EPA/NOAA CAMEO:hazardous materials
RTECS:1569-69-3
 
References:
 cyclohexanethiol
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:1569-69-3
Pubchem (cid):15290
Pubchem (sid):134981025
 
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
CHEMBL:View
HMDB (The Human Metabolome Database):Search
Export Tariff Code:2930.90.5050
Haz-Map:View
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 cyclohexane thiol
 cyclohexanethiol
 cyclohexanthiol
 cyclohexylmercaptan
 cyclohexylthiol
 hexahydrothiophenol
 mercaptocyclohexane
 
 
Notes:
None found
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