119-62-0

Name 2-Amino-1-(4-nitrophenyl)-1,3-propanediol
CAS 119-62-0
EINECS(EC#) 204-338-1
Molecular Formula C9H12N2O4
MDL Number MFCD00066778
Molecular Weight 212.2
MOL File 119-62-0.mol
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Chemical Properties

Melting point  163-165 °C
Boiling point  451.9±45.0 °C(Predicted)
density  1.410±0.06 g/cm3(Predicted)
pka 10.98±0.45(Predicted)
InChI InChI=1S/C9H12N2O4/c10-8(5-12)9(13)6-1-3-7(4-2-6)11(14)15/h1-4,8-9,12-13H,5,10H2
InChIKey OCYJXSUPZMNXEN-UHFFFAOYSA-N
SMILES C(C1=CC=C([N+]([O-])=O)C=C1)(O)C(N)CO
NIST Chemistry Reference 1,3-Propanediol, 2-amino-1-(4-nitrophenyl)-(119-62-0)

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