42112-06-1

42112-06-1 structure

42112-06-1 structure

Name: 4-hydroxy-4-oxobutanoate,[2-methyl-2-(4-piperidin-1-ylphenyl)propyl]azanium
Chemical Name: 4-hydroxy-4-oxobutanoate,[2-methyl-2-(4-piperidin-1-ylphenyl)propyl]azanium
CAS Number: 42112-06-1
Molecular Formula: C₁₉H₃₀N₂O₄
Molecular Weight: 350.45300
Create Date: 2017-04-15 01:30:15
Modify Date: 2024-04-03 10:49:57

Name	4-hydroxy-4-oxobutanoate,[2-methyl-2-(4-piperidin-1-ylphenyl)propyl]azanium

Molecular Formula	C₁₉H₃₀N₂O₄
Molecular Weight	350.45300
Exact Mass	350.22100
PSA	103.86000
LogP	3.61430

CHEMICAL IDENTIFICATION

RTECS NUMBER :: NQ0350000

CHEMICAL NAME :: Isobutylamine, 2-(4-piperidinophenyl)-, succinate

CAS REGISTRY NUMBER :: 42112-06-1

LAST UPDATED :: 199007

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C15-H24-N2.C4-H6-O4

MOLECULAR WEIGHT :: 350.51

WISWESSER LINE NOTATION :: T6NTJ AR DX1&1&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 :: 400 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