110998-14-6

110998-14-6 structure

Name: diethyl (Z)-2-(2,2,5-trimethyl-4-oxopiperidin-1-yl)but-2-enedioate
Chemical Name: diethyl (Z)-2-(2,2,5-trimethyl-4-oxopiperidin-1-yl)but-2-enedioate
CAS Number: 110998-14-6
Molecular Formula: C₁₆H₂₅NO₅
Molecular Weight: 311.37300
Create Date: 2017-09-28 11:02:17
Modify Date: 2024-01-14 11:20:41

Name	diethyl (Z)-2-(2,2,5-trimethyl-4-oxopiperidin-1-yl)but-2-enedioate
Synonyms	(2,2,5-Trimethyl-4-oxo-1-piperidyl)maleic acid diethyl ester 2-Butenedioic acid,2-(2,2,5-trimethyl-4-oxo-1-piperidinyl)-,diethyl ester,(E) (E)-2-(2,2,5-Trimethyl-4-oxo-1-piperidinyl)-2-butenedioic acid diethyl ester

Density	1.088g/cm3
Boiling Point	417.3ºC at 760mmHg
Molecular Formula	C₁₆H₂₅NO₅
Molecular Weight	311.37300
Flash Point	206.2ºC
Exact Mass	311.17300
PSA	72.91000
LogP	1.62390
Vapour Pressure	3.58E-07mmHg at 25°C
Index of Refraction	1.479

CHEMICAL IDENTIFICATION

RTECS NUMBER :: EM6610000

CHEMICAL NAME :: 2-Butenedioic acid, 2-(2,2,5-trimethyl-4-oxo-1-piperidinyl)-, diethyl ester, (E)-

CAS REGISTRY NUMBER :: 110998-14-6

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C16-H25-N-O5

MOLECULAR WEIGHT :: 311.42

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

22977-58-8

762-21-0

~75%

110998-14-6

Literature: Kats, M. M.; Lavretskaya, E. F.; Chervin, I. I.; El'natashov, Yu. I.; Kostyanovskii, R. G. Pharmaceutical Chemistry Journal, 1987 , vol. 21, # 6 p. 411 - 413 Khimiko-Farmatsevticheskii Zhurnal, 1987 , vol. 21, # 6 p. 675 - 677

Precursor 2
22977-58-8 762-21-0
DownStream 0

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