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4-(Aminomethyl)-2-Nitrobenzoic Acid
[CAS# 100466-28-2]

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Identification
Name 4-(Aminomethyl)-2-Nitrobenzoic Acid
Synonyms 4-(aminomethyl)-2-nitrobenzoic acid; 4-CARBOXY-3-NITROBENZYLAMINE
Molecular Structure CAS#: 100466-28-2, 4-(Aminomethyl)-2-Nitrobenzoic Acid
Molecular Formula C8H8N2O4
Molecular Weight 196.16
CAS Registry Number 100466-28-2
SMILES c1cc(c(cc1CN)[N+](=O)[O-])C(=O)O
InChI 1S/C8H8N2O4/c9-4-5-1-2-6(8(11)12)7(3-5)10(13)14/h1-3H,4,9H2,(H,11,12)
InChIKey CAUXOWSYHOCERZ-UHFFFAOYSA-N
Properties
Density 1.466g/cm3 (Cal.)
Boiling point 417.205°C at 760 mmHg (Cal.)
Flash point 206.119°C (Cal.)
Refractive index 1.64 (Cal.)
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