110998-16-8

110998-16-8 structure

110998-16-8 structure

Name: methyl 3-[(2R,5S)-2,5-dimethyl-4-oxopiperidin-1-yl]propanoate
Chemical Name: methyl 3-[(2R,5S)-2,5-dimethyl-4-oxopiperidin-1-yl]propanoate
CAS Number: 110998-16-8
Molecular Formula: C₁₁H₁₉NO₃
Molecular Weight: 213.27300
Create Date: 2017-12-31 08:27:41
Modify Date: 2024-04-03 11:59:25

Name	methyl 3-[(2R,5S)-2,5-dimethyl-4-oxopiperidin-1-yl]propanoate
Synonyms	1-Piperidinepropanoic acid,2,5-dimethyl-4-oxo-,methyl ester,trans trans-2,5-Dimethyl-4-oxo-1-piperidinepropanoic acid methyl ester

Density	1.025g/cm3
Boiling Point	310.8ºC at 760mmHg
Molecular Formula	C₁₁H₁₉NO₃
Molecular Weight	213.27300
Flash Point	141.8ºC
Exact Mass	213.13600
PSA	46.61000
LogP	0.78680
Vapour Pressure	0.000587mmHg at 25°C
Index of Refraction	1.455

CHEMICAL IDENTIFICATION

RTECS NUMBER :: TN2413500

CHEMICAL NAME :: 1-Piperidinepropanoic acid, 2,5-dimethyl-4-oxo-, methyl ester, trans-

CAS REGISTRY NUMBER :: 110998-16-8

LAST UPDATED :: 198903

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H19-N-O3

MOLECULAR WEIGHT :: 213.31

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 :: 300 mg/kg

TOXIC EFFECTS :: Behavioral - excitement Behavioral - rigidity (including catalepsy)

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: 21,411,1987