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(2-benzothiazolyl thio) methyl thiocyanate

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Name:1,3-benzothiazol-2-ylsulfanylmethyl thiocyanate
CAS Number: 21564-17-0Picture of molecule3D/inchi
Other(deleted CASRN):56532-60-6
ECHA EINECS - REACH Pre-Reg:244-445-0
FDA UNII: 5GE166YVQV
Nikkaji Web:J10.910J
Beilstein Number:1213014
XlogP3:3.10 (est)
Molecular Weight:238.35582000
Formula:C9 H6 N2 S3
NMR Predictor:Predict (works with chrome, Edge or firefox)
Category:indirect food additives: paper and paperboard components
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
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FDA Mainterm (IAUFC):21564-17-0 ; 2-(THIOCYANOMETHYLTHIO) BENZOTHIAZOLE
 
Physical Properties:
Assay: 95.00 to 100.00
Food Chemicals Codex Listed: No
Soluble in:
 water, 125 mg/L @ 24C (exp)
 water, 41.67 mg/L @ 25 °C (est)
 
Organoleptic Properties:
Odor and/or flavor descriptions from others (if found).
 
Cosmetic Information:
None found
 
Suppliers:
BOC Sciences
For experimental / research use only.
Tolcide 2230
Odor: characteristic
Use: Tolcide 2230 is an antimicrobial agent used as a substitute for chlorophenols
 
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
 
Safety in Use Information:
Category:
indirect food additives: paper and paperboard components
Recommendation for (2-benzothiazolyl thio) methyl thiocyanate usage levels up to:
 not for fragrance use.
 
Recommendation for (2-benzothiazolyl thio) methyl thiocyanate flavor usage levels up to:
 not for flavor use.
 
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 :30692
National Institute of Allergy and Infectious Diseases:Data
WGK Germany:3
1,3-benzothiazol-2-ylsulfanylmethyl thiocyanate
Chemidplus:0021564170
RTECS:21564-17-0
 
References:
 1,3-benzothiazol-2-ylsulfanylmethyl thiocyanate
NIST Chemistry WebBook:Search Inchi
Canada Domestic Sub. List:21564-17-0
Pubchem (cid):30692
Pubchem (cas):21564-17-0
 
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
FDA Indirect Additives used in Food Contact Substances:View
CHEMBL:View
HMDB (The Human Metabolome Database):Search
ChemSpider:View
 
Potential Blenders and core components note
None Found
 
Potential Uses:
None Found
 
Occurrence (nature, food, other):note
 not found in nature
 
Synonyms:
 benthiazole
(benzothiazol-2-yl thio) methyl thiocyanate
1,3-benzothiazol-2-ylsulfanylmethyl thiocyanate
 busan 30
 busan 72
 TCMTB
 thiocyanic acid, (2-benzothiazolylthio)methyl ester
2-(thiocyanomethyl thio) benzothiazole
 
 
Notes:
None found
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