hexyl thiocyanate
thiocyanic acid, hexyl ester
 
Notes:
None found
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CAS Number: 6803-40-3Picture of molecule3D/inchi
FDA UNII: SCX6IA45CK
Nikkaji Web: J48.850J
Beilstein Number: 1748295
MDL: MFCD00040188
XlogP3-AA: 3.30 (est)
Molecular Weight: 143.25261000
Formula: C7 H13 N S
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome or firefox)
Category: information only not used for fragrances or flavors
 
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
Soluble in:
 water, 155.7 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:
Santa Cruz Biotechnology
For experimental / research use only.
Hexyl Thiocyanate
Sigma-Aldrich: Aldrich
For experimental / research use only.
Hexyl Thiocyanate
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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:
subcutaneous-rabbit LDLo 100 mg/kg
BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD AUTONOMIC NERVOUS SYSTEM: OTHER (DIRECT) PARASYMPATHOMIMETIC
Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 150, Pg. 257, 1930.

Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: information only not used for fragrances or flavors
Recommendation for hexyl thiocyanate usage levels up to:
 not for fragrance use.
 
Recommendation for hexyl thiocyanate flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 81257
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 hexyl thiocyanate
Chemidplus: 0006803403
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References:
 hexyl thiocyanate
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 81257
Pubchem (sid): 658208
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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:
 thiocyanic acid, hexyl ester
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