Thioacetic acid S-(2-fluoroethyl) ester

Modify Date: 2024-01-10 08:08:17

Thioacetic acid S-(2-fluoroethyl) ester Structure
Thioacetic acid S-(2-fluoroethyl) ester structure
Common Name Thioacetic acid S-(2-fluoroethyl) ester
CAS Number 462-31-7 Molecular Weight 122.16100
Density 1.099g/cm3 Boiling Point 140.4ºC at 760 mmHg
Molecular Formula C4H7FOS Melting Point N/A
MSDS N/A Flash Point 38.7ºC

 Names

Name S-(2-fluoroethyl) ethanethioate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.099g/cm3
Boiling Point 140.4ºC at 760 mmHg
Molecular Formula C4H7FOS
Molecular Weight 122.16100
Flash Point 38.7ºC
Exact Mass 122.02000
PSA 42.37000
LogP 1.23560
Vapour Pressure 6.15mmHg at 25°C
Index of Refraction 1.431

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AJ6950000
CHEMICAL NAME :
Acetic acid, thio-, S-(2-fluoroethyl) ester
CAS REGISTRY NUMBER :
462-31-7
BEILSTEIN REFERENCE NO. :
1743106
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C4-H7-F-O-S
MOLECULAR WEIGHT :
122.17
WISWESSER LINE NOTATION :
F2SV1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JACSAT Journal of the American Chemical Society. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1879- Volume(issue)/page/year: 78,3843,1956
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NATUAS Nature. (Nature Subscription Dept., POB 1018, Manasguan, NJ 08736) V.1- 1869- Volume(issue)/page/year: 174,737,1954

 Synthetic Route

~%

Thioacetic acid S-(2-fluoroethyl) ester Structure

Thioacetic acid...

CAS#:462-31-7

Literature: Howell et al. Journal of the American Chemical Society, 1956 , vol. 78, p. 3843,3845

~%

Thioacetic acid S-(2-fluoroethyl) ester Structure

Thioacetic acid...

CAS#:462-31-7

Literature: Gryszkiewicz-Trochimowski Recueil des Travaux Chimiques des Pays-Bas, 1947 , vol. 66, p. 428

~%

Thioacetic acid S-(2-fluoroethyl) ester Structure

Thioacetic acid...

CAS#:462-31-7

Literature: du Pont de Nemours and Co. Patent: US2439203 , 1944 ;

~%

Thioacetic acid S-(2-fluoroethyl) ester Structure

Thioacetic acid...

CAS#:462-31-7

Literature: du Pont Patent: US2439203 , 1944 ;

 Synonyms

2-fluoroethyl thioacetate
Ethanethioic S-acid,2-fluoroethyl ester
2-Fluoroethyl thiolacetate