4-mercapto-5-nonanone
5-nonanone, 4-mercapto-
 
Notes:
None found
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CAS Number: 63458-80-0Picture of molecule3D/inchi
XlogP3-AA: 2.90 (est)
Molecular Weight: 174.30666000
Formula: C9 H18 O S
NMR Predictor: Predict (works with chrome or firefox)
Category: information only not used for fragrances or flavors
 
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Soluble in:
 water, 366 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor Type: green
 
Odor Strength: high ,
recommend smelling in a 0.10 % solution or less
 
 green  fruity  grapefruit  minty  leafy  
Odor Description:
at 0.10 % in propylene glycol. 
green fruity grapefruit mint leafy
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Aston Chemical
For experimental / research use only.
5-Nonanone, 4-mercapto-
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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: information only not used for fragrances or flavors
Recommendation for 4-mercapto-5-nonanone usage levels up to:
 not for fragrance use.
 
Recommendation for 4-mercapto-5-nonanone 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 : 20519098
National Institute of Allergy and Infectious Diseases: Data
 4-sulfanylnonan-5-one
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References:
 4-sulfanylnonan-5-one
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 20519098
Pubchem (sid): 177547840
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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
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
 grapefruitFR
 green leafFR
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
5-nonanone, 4-mercapto-
4-sulfanyl-5-nonanone
4-sulfanylnonan-5-one
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Articles:
 None found yet.
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