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94769-27-4

94769-27-4 structure
94769-27-4 structure

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