8-Amino-7-fluoroquinoline-4-carboxylic acid

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Basic information

CAS: 1420793-92-5
Standard SMILES: Nc1c(F)ccc2c(C(=O)O)ccnc12
InChIKey: XLMUMPKYKJPNQW-UHFFFAOYSA-N
Molecular formula: C10H7FN2O2
Average molar mass: 206.17 g/mol
Monoisotopic mass: 206.04915563

Names & identifiers

Preferred name: 8-Amino-7-fluoroquinoline-4-carboxylic acid
IUPAC: 8-amino-7-fluoroquinoline-4-carboxylic acid

Names & synonyms

8-Amino-7-fluoroquinoline-4-carboxylic acid1420793-92-58-Amino-7-fluoro-quinoline-4-carboxylic acidDTXSID301252043SB702768-Amino-7-fluoroquinoline-4-carboxylicacid4-Quinolinecarboxylic acid, 8-amino-7-fluoro-

Database identifiers

CAS: 1420793-92-5
PubChem CID: 97036837
DTXSID: DTXSID301252043

Properties

Computed structural properties

XLogP: 1.1
Topological polar surface area: 76.2 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 1
Heavy atoms: 15
Formal charge: 0
Complexity: 262

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Compound notes

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