THIOCYANATOACETIC ACID PROPYL ESTER

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Names

[ CAS No. ]:
5349-21-3

[ Name ]:
THIOCYANATOACETIC ACID PROPYL ESTER

[Synonym ]:
Thiocyano-essigsaeure-N-propyl-ester [German]
Propyl thiocyanatoacetate
ACETIC ACID,THIOCYANATO-,PROPYL ESTER
Thiocyano-essigsaeure-N-propyl-ester
Thiocyanatoacetic acid propyl ester

Chemical & Physical Properties

[ Density]:
1.15g/cm3

[ Boiling Point ]:
241.2ºC at 760 mmHg

[ Molecular Formula ]:
C6H9NO2S

[ Molecular Weight ]:
159.20600

[ Flash Point ]:
99.7ºC

[ Exact Mass ]:
159.03500

[ PSA ]:
75.39000

[ LogP ]:
1.15388

[ Index of Refraction ]:
1.483

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AJ6331000
CHEMICAL NAME :
Acetic acid, thiocyanato-, propyl ester
CAS REGISTRY NUMBER :
5349-21-3
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C6-H9-N-O2-S
MOLECULAR WEIGHT :
159.22
WISWESSER LINE NOTATION :
NCS1VO3

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
40 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 16,870,1966

Safety Information

[ HS Code ]:
2930909090

Customs

[ HS Code ]: 2930909090

[ Summary ]:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Related Compounds

  • Thiiranecarboxylic acid, propyl ester, (S)- (9CI)
  • Chlorooxoacetic acid propyl ester
  • Chlorosulfuric acid propyl ester
  • Hydrazinecarboxylic acid,propyl ester
  • elaidic acid propyl ester
  • Dithiobenzoic acid propyl ester
  • 2-(2-Methoxy-2-oxoethanesulfonyl)acetic acid
  • N-(3,5-dimethoxyphenyl)-N'-{3-[2-(1-methyl-1H-benzimidazol-2-yl)ethyl]phenyl}urea
  • 3-{[4-(2-chlorophenyl)piperazin-1-yl]sulfonyl}-N-[(2-fluorophenyl)methyl]-1-methyl-1H-pyrazole-4-carboxamide
  • 3-{[4-(2-chlorophenyl)piperazin-1-yl]sulfonyl}-1-methyl-N-[(2-methylphenyl)methyl]-1H-pyrazole-4-carboxamide
  • 3-{[4-(2-chlorophenyl)piperazin-1-yl]sulfonyl}-N-cyclohexyl-1-propyl-1H-pyrazole-4-carboxamide
  • 3-{[4-(2-chlorophenyl)piperazin-1-yl]sulfonyl}-N-(2-methoxyethyl)-1-propyl-1H-pyrazole-4-carboxamide
  • 3-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-N-cyclohexyl-1-methyl-1H-pyrazole-4-carboxamide
  • 3-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-1-methyl-N-(4-methylcyclohexyl)pyrazole-4-carboxamide
  • 3-((4-(3-chlorophenyl)piperazin-1-yl)sulfonyl)-N-cycloheptyl-1-methyl-1H-pyrazole-4-carboxamide
  • 3-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-N-[2-(cyclohex-1-en-1-yl)ethyl]-1-methyl-1H-pyrazole-4-carboxamide
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