Carbonochloridothioicacid, S-propyl ester

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Names

[ CAS No. ]:
13889-92-4

[ Name ]:
Carbonochloridothioicacid, S-propyl ester

[Synonym ]:
n-Propyl chlorothioformate
Propyl chlorothioformate
Carbonochloridothioic acid,S-propyl ester
(Propylthio)carbonylchlorid
n-Propyl chlorothiolformate
S-Propyl thiochloroformate
Propyl chlorothiolformate
S-(n-propyl)chlorothioformic acid
(C3H7-n)SCOCl
thiocarbonochloridic acid S-propyl ester
n-Propyl thiochloroformate
S-n-propyl chlorothioformate
PROPYL CHLOROTHIOLFORMATE
S-PROPYL CHLOROTHIOFORMATE

Chemical & Physical Properties

[ Density]:
1.149 g/mL at 25ºC

[ Boiling Point ]:
37ºC/ 8 mmHg

[ Molecular Formula ]:
C4H7ClOS

[ Molecular Weight ]:
138.61600

[ Flash Point ]:
49ºC

[ Exact Mass ]:
137.99100

[ PSA ]:
42.37000

[ LogP ]:
2.48840

[ Vapour Pressure ]:
3.04mmHg at 25°C

[ Index of Refraction ]:
n 20/D 1.4807

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
LQ7005000
CHEMICAL NAME :
Formic acid, chlorothio-, S-propyl ester
CAS REGISTRY NUMBER :
13889-92-4
BEILSTEIN REFERENCE NO. :
1633747
LAST UPDATED :
199701
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C4-H7-Cl-O-S
MOLECULAR WEIGHT :
138.62

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1129 mg/kg
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - lacrimation Behavioral - altered sleep time (including change in righting reflex) Skin and Appendages - hair
REFERENCE :
STCC** Stauffer Chemical Co., Product Safety Information Sheets. (Stauffer Chemical Co., Agricultural Chemical Div., Westport, CT 06880)
TYPE OF TEST :
LCLo - Lowest published lethal concentration
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
1300 mg/m3
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - chronic pulmonary edema Liver - other changes
REFERENCE :
STCC** Stauffer Chemical Co., Product Safety Information Sheets. (Stauffer Chemical Co., Agricultural Chemical Div., Westport, CT 06880)
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
4500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
STCC** Stauffer Chemical Co., Product Safety Information Sheets. (Stauffer Chemical Co., Agricultural Chemical Div., Westport, CT 06880)

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
1 mg/plate
REFERENCE :
EMMUEG Environmental and Molecular Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.10- 1987- Volume(issue)/page/year: 19(Suppl 21),2,1992

Safety Information

[ Symbol ]:

GHS02, GHS05, GHS07

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H226-H302-H314

[ Precautionary Statements ]:
P280-P305 + P351 + P338-P310

[ Personal Protective Equipment ]:
Faceshields;full-face respirator (US);Gloves;Goggles;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Risk Phrases ]:
10-22-34

[ RIDADR ]:
UN 2920 8/PG 2

[ RTECS ]:
LQ7005000

[ HS Code ]:
2930909090

Synthetic Route

Precursor & DownStream

Precursor

  • phosgene
  • 1-Propanethiol
  • Propyl thiocyanate
  • benzylmalonyl dichloride

DownStream

  • Benzenecarbothioicacid, S-propyl ester
  • S-propyl N-methylcarbamothioate
  • S-propyl N-propylcarbamothioate

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

  • Benzenecarbothioicacid, S-propyl ester
  • ethanethiosulfonic acid S-propyl ester
  • 1-Propanesulfinothioicacid, S-propyl ester
  • Octanethioic acid S-propyl ester
  • Hexanethioic acid S-propyl ester
  • Thiovaleric acid S-propyl ester
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 4-(1-Benzofuran-6-yl)-1,2,3,6-tetrahydropyridine
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • 2-Amino-2-(3,4-dichlorophenyl)acetonitrile hydrochloride
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine