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Home> Hot Product Listed P   > Propanedioic acid,2-(3-phenylpropyl)-
1171381-49-9 structure

Propanedioic acid,2-(3-phenylpropyl)-

Iupac Name:(4-bromo-2-methylphenyl)methanamine;hydrochloride
CAS No.:1171381-49-9
EINECS(EC#): 246-204-5
Molecular Weight:236.537
Molecular Formula:C17H29CLNO4P (isomer)
Properties
Density
1.18
Flash Point
293.2°C
Computational chemical data
  • Molecular Weight:236.537g/mol
  • Molecular Formula:C17H29CLNO4P
  • Compound Is Canonicalized:True
  • Exact Mass:234.976
  • Monoisotopic Mass:234.976
  • Complexity:105
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:2
  • Hydrogen Bond Acceptor Count:1
  • Topological Polar Surface Area:26A^2
  • Heavy Atom Count:11
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:2
  • CACTVS Substructure Key Fingerprint: AAADccByAAAEEAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAHABQAAABrADBGAQyAIBAAACA AiBCAACCAAAgAAQIiIAABKgIICKAkRGAIABggAAIihcQgIAOggAAEAAQAAAEAAAgACAAAAAAAAAA AA==
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