Cas no 715653-77-3 (Benzenepropanoic acid, b-amino-3-phenoxy-, (bR)-)

Benzenepropanoic acid, b-amino-3-phenoxy-, (bR)- structure
715653-77-3 structure
Product Name:Benzenepropanoic acid, b-amino-3-phenoxy-, (bR)-
CAS No:715653-77-3
MF:C15H15NO3
MW:257.284504175186
CID:558147
PubChem ID:776378
Update Time:2023-10-31

Benzenepropanoic acid, b-amino-3-phenoxy-, (bR)- Chemical and Physical Properties

Names and Identifiers

    • Benzenepropanoic acid, b-amino-3-phenoxy-, (bR)-
    • (R)-?-(3-Phenoxyphenyl)alanine
    • (R)-3-(3-PHENOXYPHENYL)-BETA-ALANINE
    • (R)-?-(3-PHENOXYPHENYL)ALANINE
    • (3R)-3-Amino-3-(3-phenoxyphenyl)propanoic acid
    • Benzenepropanoic acid, beta-amino-3-phenoxy-, (betaR)-
    • (r)-beta-(3-phenoxyphenyl)alanine
    • (R)-3-Amino-3-(3-phenoxyphenyl)propanoic acid
    • 715653-77-3
    • EN300-22046871
    • SCHEMBL7088219
    • MFCD07784129
    • (r)-3-amino-3-(3-phenoxyphenyl)propionic acid
    • AKOS025312497
    • (r)-3-amino-3-(3-phenoxy-phenyl)-propionic acid
    • (R)-3-Amino-3-(3-phenoxyphenyl)propanoicacid
    • (R)- -(3-Phenoxyphenyl)alanine
    • MDL: MFCD07784129
    • Inchi: 1S/C15H15NO3/c16-14(10-15(17)18)11-5-4-8-13(9-11)19-12-6-2-1-3-7-12/h1-9,14H,10,16H2,(H,17,18)/t14-/m1/s1
    • InChI Key: DOHHGYXZPWMNKT-CQSZACIVSA-N
    • SMILES: O(C1C=CC=CC=1)C1=CC=CC(=C1)[C@@H](CC(=O)O)N

Computed Properties

  • Exact Mass: 257.10519334g/mol
  • Monoisotopic Mass: 257.10519334g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 5
  • Complexity: 289
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -0.4
  • Topological Polar Surface Area: 72.6?2

Experimental Properties

  • Density: 1.234
  • Boiling Point: 421.7°C at 760 mmHg
  • Flash Point: 208.8°C
  • Refractive Index: 1.607
  • PSA: 72.55000
  • LogP: 3.65370

Benzenepropanoic acid, b-amino-3-phenoxy-, (bR)- Pricemore >>

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