8-phenyl octyl isothiocyanate
benzene, (8-isothiocyanatoctyl)-
 
Notes:
None found
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CAS Number: 157469-20-0Picture of molecule3D/inchi
Nikkaji Web: J594.707C
XlogP3-AA: 6.40 (est)
Molecular Weight: 247.40437000
Formula: C15 H21 N 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, 0.267 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
 None found
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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 8-phenyl octyl isothiocyanate usage levels up to:
 not for fragrance use.
 
Recommendation for 8-phenyl octyl isothiocyanate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
Chemical Carcinogenesis Research Information System: Search
AIDS Citations: Search
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EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 154690
National Institute of Allergy and Infectious Diseases: Data
 8-isothiocyanatooctylbenzene
Chemidplus: 0157469200
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References:
 8-isothiocyanatooctylbenzene
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 154690
Pubchem (sid): 135109422
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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
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:
 benzene, (8-isothiocyanatoctyl)-
8-phenyloctyl isothiocyanate
(8-isothiocyanatooctyl)benzene
8-isothiocyanatooctylbenzene
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