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Substance Name: Butyronitrile, 3-methyl-2-(2-morpholinoethyl)-2-phenyl-
RN: 1224-39-1
InChIKey: PUJOAWZWLJQUCU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H24-N2-O

Molecular Weight

  • 272.39
 
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Names and Synonyms

Synonyms

  • 3-Methyl-2-(2-morpholinoethyl)-2-phenylbutyronitrile
  • BRN 1081095
  • Butyronitrile, 2-isopropyl-4-morpholino-2-phenyl-
  • Pentane, 3-cyano-2-methyl-5-morpholino-3-phenyl

Systematic Name

  • Butyronitrile, 3-methyl-2-(2-morpholinoethyl)-2-phenyl-

Registry Numbers

CAS Registry Number

  • 1224-39-1

System Generated Number

  • 0001224391

Structure Descriptors

InChI

1S/C17H24N2O/c1-15(2)17(14-18,16-6-4-3-5-7-16)8-9-19-10-12-20-13-11-19/h3-7,15H,8-13H2,1-2H3

InChIKey

PUJOAWZWLJQUCU-UHFFFAOYSA-N

Smiles

c1([C@@](CCN2CCOCC2)(C(C)C)C#N)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 280mg/kg (280mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 589, 1965.