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Home >> Chemical Listing >> Page 2875 >> 4-(6-Nitro-3-pyridinyl)benzoic acid

4-(6-Nitro-3-pyridinyl)benzoic acid
[CAS# 885476-90-4]

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Identification
Name 4-(6-Nitro-3-pyridinyl)benzoic acid
Synonyms BENZOIC ACID,4-(6-NITRO-3-PYRIDINYL)-
Molecular Structure CAS#: 885476-90-4, 4-(6-Nitro-3-pyridinyl)benzoic acid
Molecular Formula C12H8N2O4
Molecular Weight 244.20
CAS Registry Number 885476-90-4
SMILES O=[N+]([O-])c2ncc(c1ccc(C(=O)O)cc1)cc2
InChI 1S/C12H8N2O4/c15-12(16)9-3-1-8(2-4-9)10-5-6-11(13-7-10)14(17)18/h1-7H,(H,15,16)
InChIKey BRLFBOIOJXWHEC-UHFFFAOYSA-N
Properties
Density 1.417g/cm3 (Cal.)
Boiling point 497.795°C at 760 mmHg (Cal.)
Flash point 254.858°C (Cal.)
Refractive index 1.644 (Cal.)
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