42111-98-8

42111-98-8 structure

42111-98-8 structure

Name: butanedioic acid,2-(3-piperidin-1-ylphenyl)propan-1-amine
Chemical Name: butanedioic acid,2-(3-piperidin-1-ylphenyl)propan-1-amine
CAS Number: 42111-98-8
Molecular Formula: C₁₈H₂₈N₂O₄
Molecular Weight: 336.42600
Create Date: 2017-10-12 19:06:08
Modify Date: 2024-04-04 10:36:50

Name	butanedioic acid,2-(3-piperidin-1-ylphenyl)propan-1-amine

Molecular Formula	C₁₈H₂₈N₂O₄
Molecular Weight	336.42600
Exact Mass	336.20500
PSA	103.86000
LogP	3.44020

CHEMICAL IDENTIFICATION

RTECS NUMBER :: SI1061000

CHEMICAL NAME :: Phenethylamine, beta-methyl-3-piperidino-, succinate

CAS REGISTRY NUMBER :: 42111-98-8

LAST UPDATED :: 199007

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C14-H22-N2.C4-H6-O4

MOLECULAR WEIGHT :: 336.48

WISWESSER LINE NOTATION :: T6NTJ AR CY1&1Z &QV2VQ

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 :: 600 mg/kg

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

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: 22,1460,1979