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Basic Information
CAS No.: 30163-20-3
Name: 2-AMINO-3-(3-BROMO-PHENYL)-PROPIONIC ACID
Article Data: 3
Molecular Structure:
Molecular Structure of 30163-20-3 (2-AMINO-3-(3-BROMO-PHENYL)-PROPIONIC ACID)
Formula: C9H10BrNO2
Molecular Weight: 244.088
Synonyms: DL-Phenylalanine,3-bromo-;2-Amino-3-(3-bromophenyl)propanoic acid;3-Bromo-DL-phenylalanine;
Density: 1.588 g/cm3
Boiling Point: 368.4 °C at 760 mmHg
Flash Point: 176.6 °C
PSA: 63.32000
LogP: 2.10380
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Chemistry

IUPAC Name: (2S)-2-Amino-3-(3-bromophenyl)propanoic acid
Synonyms of 3-Bromophenylalanine (CAS NO.30163-20-3): 2-Amino-3-(3-bromophenyl)propanoic acid ; 3-Bromo-DL-phenylalanine
CAS NO: 30163-20-3
Molecular Formula: C9H10BrNO2
Molecular Weight: 244.09
Molecular Structure:
H bond acceptors: 3
H bond donors: 3
Freely Rotating Bonds: 4
Polar Surface Area: 29.54 Å2
Index of Refraction: 1.608
Molar Refractivity: 53.18 cm3
Molar Volume: 153.6 cm3
Surface Tension: 57.1 dyne/cm
Density: 1.588 g/cm3
Flash Point: 176.6 °C
Enthalpy of Vaporization: 64.89 kJ/mol
Boiling Point: 368.4 °C at 760 mmHg
Vapour Pressure: 4.46E-06 mmHg at 25°C
SMILES: Brc1cc(ccc1)CC(C(=O)O)N Copy InChI: InChI=1/C9H10BrNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)
InChIKey: GDMOHOYNMWWBAU-UHFFFAOYAF
Std. InChI: InChI=1S/C9H10BrNO2/c10-7-3-1-2-6(4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)
Std. InChIKey: GDMOHOYNMWWBAU-UHFFFAOYSA-N
Product Categories of 3-Bromophenylalanine (CAS NO.30163-20-3): Phenylalanine analogs and other aromatic alpha amino acids;a-amino