2,4-Piperidinedicarboxylic acid, 1-(3-(acetylthio)-1-oxopropyl)-, cis-

Modify Date: 2024-01-09 09:35:24

2,4-Piperidinedicarboxylic acid, 1-(3-(acetylthio)-1-oxopropyl)-, cis- structure	Common Name	2,4-Piperidinedicarboxylic acid, 1-(3-(acetylthio)-1-oxopropyl)-, cis-
	CAS Number	94769-27-4	Molecular Weight	303.33100
	Density	1.418g/cm3	Boiling Point	546.1ºC at 760mmHg
	Molecular Formula	C₁₂H₁₇NO₆S	Melting Point	N/A
	MSDS	N/A	Flash Point	284.1ºC

Name	(2S,4R)-1-(3-acetylsulfanylpropanoyl)piperidine-2,4-dicarboxylic acid

Density	1.418g/cm3
Boiling Point	546.1ºC at 760mmHg
Molecular Formula	C₁₂H₁₇NO₆S
Molecular Weight	303.33100
Flash Point	284.1ºC
Exact Mass	303.07800
PSA	137.28000
LogP	0.37050
Index of Refraction	1.568

CHEMICAL IDENTIFICATION

RTECS NUMBER :: TM7066500

CHEMICAL NAME :: 2,4-Piperidinedicarboxylic acid, 1-(3-(acetylthio)-1-oxopropyl)-, cis-

CAS REGISTRY NUMBER :: 94769-27-4

LAST UPDATED :: 198812

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C12-H17-N-O6-S

MOLECULAR WEIGHT :: 303.36

WISWESSER LINE NOTATION :: T6NTJ AV2SV1 BVQ DVQ -C

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 285 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 18,679,1984