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2-(4-Phosphonophenyl)Alanine
[CAS# 169209-65-8]

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Identification
Name 2-(4-Phosphonophenyl)Alanine
Synonyms (RS)-a-Methyl-4-phosphonophenylglycine; (S)-MPPG; [169209-65-8]
Molecular Structure CAS#: 169209-65-8, 2-(4-Phosphonophenyl)Alanine
Molecular Formula C9H12NO5P
Molecular Weight 245.17
CAS Registry Number 169209-65-8
SMILES CC(C1=CC=C(C=C1)P(=O)(O)O)(C(=O)O)N
InChI 1S/C9H12NO5P/c1-9(10,8(11)12)6-2-4-7(5-3-6)16(13,14)15/h2-5H,10H2,1H3,(H,11,12)(H2,13,14,15)
InChIKey PAONCRJPUQXPRW-UHFFFAOYSA-N
Properties
Density 1.5±0.1g/cm3 (Cal.)
Boiling point 507.9±60.0°C at 760 mmHg (Cal.)
Flash point 261.0±32.9°C (Cal.)
Refractive index 1.619 (Cal.)
solubility Soluble to 100 mM in 1eq. NaOH
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