4-(benzylsulfanylcarbothioylamino)butanoic acid

Names

[ CAS No. ]:
63884-89-9

[ Name ]:
4-(benzylsulfanylcarbothioylamino)butanoic acid

[Synonym ]:
usaf pd-6

Chemical & Physical Properties

[ Density]:
1.278g/cm3

[ Boiling Point ]:
454.1ºC at 760 mmHg

[ Molecular Formula ]:
C12H15NO2S2

[ Molecular Weight ]:
269.38300

[ Flash Point ]:
228.4ºC

[ Exact Mass ]:
269.05400

[ PSA ]:
113.76000

[ LogP ]:
3.07040

[ Index of Refraction ]:
1.628

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EZ1370000
CHEMICAL NAME :
Carbamic acid, (3-carboxypropyl)dithio-, benzyl ester
CAS REGISTRY NUMBER :
63884-89-9
BEILSTEIN REFERENCE NO. :
3339978
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H15-N-O2-S2
MOLECULAR WEIGHT :
269.40
WISWESSER LINE NOTATION :
QV3MYUS&S1R

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 :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD277-689

Synthetic Route


Related Compounds