Propanamide,2-methyl-2-(2-propen-1-ylthio)-

Modify Date: 2025-09-28 07:47:49

Propanamide,2-methyl-2-(2-propen-1-ylthio)- structure	Common Name	Propanamide,2-methyl-2-(2-propen-1-ylthio)-
	CAS Number	63915-89-9	Molecular Weight	159.24900
	Density	1.034g/cm3	Boiling Point	275.8ºC at 760mmHg
	Molecular Formula	C₇H₁₃NOS	Melting Point	N/A
	MSDS	N/A	Flash Point	120.6ºC

Name	2-methyl-2-prop-2-enylsulfanylpropanamide
Synonym	More Synonyms

Density	1.034g/cm3
Boiling Point	275.8ºC at 760mmHg
Molecular Formula	C₇H₁₃NOS
Molecular Weight	159.24900
Flash Point	120.6ºC
Exact Mass	159.07200
PSA	68.39000
LogP	1.86980
Index of Refraction	1.505
InChIKey	NQEAWPKKPXTLGE-UHFFFAOYSA-N
SMILES	C=CCSC(C)(C)C(N)=O

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UE3030000

CHEMICAL NAME :: Propionamide, 2-(allylthio)-2-methyl-

CAS REGISTRY NUMBER :: 63915-89-9

BEILSTEIN REFERENCE NO. :: 1756434

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C7-H13-N-O-S

MOLECULAR WEIGHT :: 159.27

WISWESSER LINE NOTATION :: ZVX1&1&S2U1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 2 gm/kg

TOXIC EFFECTS :: Behavioral - somnolence (general depressed activity) Behavioral - antipsychotic

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 6,351,1963

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 250 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: AD691-490

N/A

CAS#:90001-82-4

Propanamide,2-m...

CAS#:63915-89-9

Literature: Hoffmann-La Roche Patent: US2874190 , 1957 ;

N/A

CAS#:199388-85-7

Propanamide,2-m...

CAS#:63915-89-9

Literature: Hoffmann-La Roche Patent: US2874190 , 1957 ;

2-Allylmercaptoisobutyramide

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