Compound C8H5NO6 structure

Compound C8H5NO6

3-nitrophthalic acid

CAS: 603-11-2
Molecular Formula C8H5NO6
Molecular Weight 211.13 g/mol
LogP 0.7
Topological Polar Surface Area 120.0 A2
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 6
Rotatable Bonds 2
Exact Mass 211.01169
Heavy Atoms 15
Complexity 296.0

Chemical Identifiers

CAS Number 603-11-2
SMILES C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O
InChIKey KFIRODWJCYBBHY-UHFFFAOYSA-N

📖 Product Overview

Compound C8H5NO6 (CAS: 603-11-2) is a chemical compound with molecular formula C8H5NO6 and molecular weight 211.13 g/mol. Its IUPAC systematic name is 3-nitrophthalic acid. LogP 0.7 Topological Polar Surface Area 120.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 2 Exact Mass 211.01169 Heavy Atoms 15 Complexity 296.0 InChI Key: KFIRODWJCYBBHY-UHFFFAOYSA-N. SMILES: C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)C(=O)O.

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