Cas no 103365-47-5 ((S)-3-Phenyl-3-(tert-butoxycarbonylamino)propanoic Acid)

(S)-3-Phenyl-3-(tert-butoxycarbonylamino)propanoic Acid structure
103365-47-5 structure
Product Name:(S)-3-Phenyl-3-(tert-butoxycarbonylamino)propanoic Acid
CAS No:103365-47-5
MF:C14H19NO4
MW:265.30496430397
MDL:MFCD01860892
CID:62372
PubChem ID:2734490
Update Time:2025-08-05

(S)-3-Phenyl-3-(tert-butoxycarbonylamino)propanoic Acid Chemical and Physical Properties

Names and Identifiers

    • (S)-3-((tert-Butoxycarbonyl)amino)-3-phenylpropanoic acid
    • (S)-N-Boc-beta-phenyl-beta-alanine
    • (S)-N-tert-Butoxycarbonyl-3-amino-3-phenylpropanoic acid
    • (S)-3-(Boc-amino)-3-phenylpropionic acid
    • Boc-D-Beta-Phe-OH
    • Boc-(S)-3-Amino-3-Phenylpropionic Acid
    • (S)-3-Phenyl-3-(Boc-amino)propionic acid
    • (S)-3-Phenyl-3-(tert
    • (S)-3-Phenyl-3-(tert-butoxycarbonylamino)propanoic Acid
    • (S)-N-Boc-3-Amino-3-phenylpropanoic acid
    • Boc-D-beta-phenylalanine
    • Boc-D-β-Phe-OH
    • Boc-S-3-Amino-3-phenylpropionic acid
    • (3S)-3-[(tert-butoxycarbonyl)amino]-3-phenylpropanoate
    • (3S)-3-[(tert-butoxycarbonyl)amino]-3-phenylpropanoic acid
    • 3-[(tert-butoxycarbonyl)amino]-3-phenylpropanoic acid
    • Boc-L-3-3-Amino-3-phenylpropionic acid
    • Boc-b-D-Phe-OH
    • BOC-BETA-D-PHE-OH
    • BOC-L-BETA-PHE-OH
    • RARECHEM AK PT B078
    • BOC-D-PHG-(C*CH2)OH
    • BOC-S--phenylalanine
    • Boc-beta-(S)-3-phenylalanine
    • MDL: MFCD01860892
    • Inchi: 1S/C14H19NO4/c1-14(2,3)19-13(18)15-11(9-12(16)17)10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m0/s1
    • InChI Key: JTNQFJPZRTURSI-NSHDSACASA-N
    • SMILES: O(C(N[C@@H](CC(=O)O)C1C=CC=CC=1)=O)C(C)(C)C

Computed Properties

  • Exact Mass: 264.12364
  • Monoisotopic Mass: 265.131
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 7
  • Complexity: 316
  • 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
  • Surface Charge: 0
  • Tautomer Count: 2
  • XLogP3: 2
  • Topological Polar Surface Area: 75.6A^2

Experimental Properties

  • Color/Form: White to Yellow Solid
  • Density: 1.1356 (rough estimate)
  • Melting Point: 122.9 oC
  • Boiling Point: 423.2℃ at 760 mmHg
  • Flash Point: 209.8°C
  • Refractive Index: 1.5110 (estimate)
  • PSA: 78.46
  • LogP: 3.11800
  • Solubility: Not available

(S)-3-Phenyl-3-(tert-butoxycarbonylamino)propanoic Acid Security Information

  • Signal Word:Warning
  • Hazard Statement: H303;H313;H333
  • Warning Statement: P261;P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Safety Instruction: S24/25
  • Safety Term:S24/25
  • HazardClass:IRRITANT
  • Storage Condition:Room temperature

(S)-3-Phenyl-3-(tert-butoxycarbonylamino)propanoic Acid Pricemore >>

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