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Substance Name: 4-Nitro-DL-phenylalanine
RN: 2922-40-9
InChIKey: GTVVZTAFGPQSPC-UHFFFAOYSA-N

Molecular Formula

  • C9-H10-N2-O4

Molecular Weight

  • 210.188
 
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Names and Synonyms

Synonyms

  • AI3-52611
  • EINECS 220-868-6
  • NSC 14786
  • p-Nitrophenylalanine, DL-

Systematic Names

  • 4-Nitro-DL-phenylalanine
  • DL-Phenylalanine, 4-nitro-

Registry Numbers

CAS Registry Number

  • 2922-40-9

System Generated Number

  • 0002922409

Structure Descriptors

InChI

1S/C9H10N2O4/c10-8(9(12)13)5-6-1-3-7(4-2-6)11(14)15/h1-4,8H,5,10H2,(H,12,13)

InChIKey

GTVVZTAFGPQSPC-UHFFFAOYSA-N

Smiles

[N+](c1ccc(C[C@@H](C(=O)O)N)cc1)([O-])=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -1.25E+00 (none)   EXP
Water Solubility 1570 mg/L 25 EST
Vapor Pressure 4.71E-10 mm Hg 25 EST
Henry's Law Constant 4.75E-13 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.99E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.