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4-Chlorophenylalanine
[CAS# 1991-78-2]

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Identification
Name 4-Chlorophenylalanine
Synonyms 2-Amino-3-(4-Chlorophenyl)Propionic Acid; Kbio3_002731; Kbio2_004236
Molecular Structure CAS#: 1991-78-2, 4-Chlorophenylalanine
Molecular Formula C9H10ClNO2
Molecular Weight 199.64
CAS Registry Number 1991-78-2
EINECS 217-874-6
SMILES C1=C(CC(C(O)=O)N)C=CC(=C1)Cl
InChI 1S/C9H10ClNO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)
InChIKey NIGWMJHCCYYCSF-UHFFFAOYSA-N
Properties
Density 1.3±0.1g/cm3 (Cal.)
Melting point 265°C (Expl.)
Boiling point 339.5±32.0°C at 760 mmHg (Cal.)
Flash point 159.1±25.1°C (Cal.)
solubility Soluble to 10 mM in 1eq. NaOH and to 5 mM in water
Safety Data
Safety Description CAUTION: May irritate eyes, skin, and respiratory tract
References
(1) Hadi Lioe and Richard A. J. O'Hair. Neighbouring group processes in the deamination of protonated phenylalanine derivatives, Org. Biomol. Chem., 2005, 3, 3618.
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