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Substance Name: N-desmethylflunitrazepam
RN: 2648-00-2
InChIKey: BHRKXOYRRFPATI-UHFFFAOYSA-N

Note

  • Metabolite of flunitrazepam.

Molecular Formula

  • C15-H11-F-N2-O

Molecular Weight

  • 254.2629
 
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Names and Synonyms

Name of Substance

  • N-Desmethylflunitrazepam

Synonym

  • Ro 05-3061

Systematic Name

  • 2H-1,4-Benzodiazepin-2-one, 7-fluoro-1,3-dihydro-5-phenyl-

Registry Numbers

CAS Registry Number

  • 2648-00-2

System Generated Number

  • 0002648002

Structure Descriptors

InChI

1S/C15H11FN2O/c16-11-6-7-13-12(8-11)15(17-9-14(19)18-13)10-4-2-1-3-5-10/h1-8H,9H2,(H,18,19)

InChIKey

BHRKXOYRRFPATI-UHFFFAOYSA-N

Smiles

c1ccc(cc1)C2=NCC(=O)Nc3c2cc(cc3)F

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.32 (none)   EXP
Water Solubility 234 mg/L 25 EST
Vapor Pressure 2.84E-08 mm Hg 25 EST
Henry's Law Constant 2.80E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.00E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.