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

  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine
  • 4-amino-N-[2-tert-butyl-1-(tetrahydro-2H-pyran-4-ylmethyl)-1H-benzimidazol-5-yl]-N-ethylbenzenesulfonamide
  • N-[3-(Aminooxy)propyl]-N-butyl-1-butanamine