Cas no 3387-86-8 (3-aminotyrosine)

3-aminotyrosine structure
3-aminotyrosine structure
Product Name:3-aminotyrosine
CAS No:3387-86-8
MF:C9H12N2O3
MW:196.203182220459
CID:1465778
PubChem ID:3084398
Update Time:2025-04-20

3-aminotyrosine Chemical and Physical Properties

Names and Identifiers

    • 3-Aminotyrosine
    • 3-amino-DL-tyrosine
    • 3-Aminotyrosin
    • 3-(phenylmethyl)aniline
    • 3-amino-tyrosine
    • [3-(benzyl)phenyl]amine
    • 3-Amino-DL-tyrosin
    • 3-(Phenylmethyl)benzenamine
    • 3-aminodiphenylmethane
    • 3-benzyl-aniline
    • 3-Amino-tyrosin
    • 3-benzylphenylamine
    • DL-3-AMINO-4-HYDROXYPHENYLALANINE
    • 2-azanyl-3-(3-azanyl-4-oxidanyl-phenyl)propanoic acid
    • BBL028235
    • 3387-86-8
    • AKOS015962944
    • 3-amino-4-hydroxyphenylalanine
    • PD167633
    • STL372949
    • A820149
    • 2-amino-3-(3-amino-4-hydroxyphenyl)propanoic acid
    • SCHEMBL180009
    • BDBM36555
    • AF-407/02988015
    • AC-19156
    • 3-aminotyrosine
    • Inchi: 1S/C9H12N2O3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,10-11H2,(H,13,14)
    • InChI Key: POGSZHUEECCEAP-UHFFFAOYSA-N
    • SMILES: OC(C(CC1C=CC(=C(C=1)N)O)N)=O

Computed Properties

  • Exact Mass: 196.08486
  • Monoisotopic Mass: 196.08479225g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 210
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -3.1
  • Topological Polar Surface Area: 110?2

Experimental Properties

  • PSA: 109.57
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