2-Phenyl-2-(2-piperidinoethyl)-3-methylbutyronitrile

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Names

[ CAS No. ]:
2809-50-9

[ Name ]:
2-Phenyl-2-(2-piperidinoethyl)-3-methylbutyronitrile

[Synonym ]:
2-isopropyl-2-phenyl-4-piperidin-1-yl-butyronitrile

Chemical & Physical Properties

[ Density]:
0.99g/cm3

[ Boiling Point ]:
408.3ºC at 760mmHg

[ Molecular Formula ]:
C18H26N2

[ Molecular Weight ]:
270.41200

[ Flash Point ]:
169.3ºC

[ Exact Mass ]:
270.21000

[ PSA ]:
27.03000

[ LogP ]:
3.91788

[ Vapour Pressure ]:
7.05E-07mmHg at 25°C

[ Index of Refraction ]:
1.52

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EU0670000
CHEMICAL NAME :
Butyronitrile, 2-phenyl-2-(2-piperidinoethyl)-3-methyl-
CAS REGISTRY NUMBER :
2809-50-9
BEILSTEIN REFERENCE NO. :
1348599
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H26-N2
MOLECULAR WEIGHT :
270.46
WISWESSER LINE NOTATION :
T6NTJ A2XR&CN&Y1&1

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 :
70 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: 8,589,1965

Related Compounds

  • (2-Amino-4,5-dimethylphenyl)methanol
  • 4-(2-methoxy-5-methylphenyl)-2-piperidin-4-yl-1H-pyrrolo[2,3-b]pyridine
  • Methyl 2-((3-methyl-4-nitroisothiazol-5-yl)carbamoyl)benzoate
  • 2-Bromo-3-chloro-6-iodopyridine
  • 2-Amino-5-(2-(dimethylamino)ethoxy)pyrazolo[1,5-a]pyrimidine-3-carboxylic acid
  • trans-4-[4-[4-(5-Fluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-3,6-dihydro-1(2H)-pyridinyl]cyclohexaneacetic acid
  • N-benzyl-6-bromo-5-methoxypyridin-2-amine
  • methyl 3-(5-chloro-4-(6-fluoropyridin-2-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl)piperidine-1-carboxylate
  • 1,1-Dimethylethyl 2-[4-(5-fluoro-2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-5,5-dimethyl-4-morpholinecarboxylate
  • 1,1-Dimethylethyl 4-[4-(2-methoxy-5-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-2-yl]-1-piperidinecarboxylate
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