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Home >> Chemical Listing >> Page 787 >> 4-Nitro-1H-Benzimidazole-2-Carboxylic Acid

4-Nitro-1H-Benzimidazole-2-Carboxylic Acid
[CAS# 189045-24-7]

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Identification
Name 4-Nitro-1H-Benzimidazole-2-Carboxylic Acid
Synonyms 1H-BENZIMIDAZOLE-2-CARBOXYLICACID, 7-NITRO-; 4-nitro-1H-benzo[d]imidazole-2-carboxylic acid
Molecular Structure CAS#: 189045-24-7, 4-Nitro-1H-Benzimidazole-2-Carboxylic Acid
Molecular Formula C8H5N3O4
Molecular Weight 207.14
CAS Registry Number 189045-24-7
SMILES c1cc2c(c(c1)[N+](=O)[O-])[nH]c(n2)C(=O)O
InChI 1S/C8H5N3O4/c12-8(13)7-9-4-2-1-3-5(11(14)15)6(4)10-7/h1-3H,(H,9,10)(H,12,13)
InChIKey CYAFDAPFBQTRBU-UHFFFAOYSA-N
Properties
Density 1.734g/cm3 (Cal.)
Boiling point 548.499°C at 760 mmHg (Cal.)
Flash point 285.522°C (Cal.)
Refractive index 1.779 (Cal.)
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