N-(2,4-Difluorophenyl)-3-nitropyridin-2-amine

HCID 12445346

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 61963-74-4
Standard SMILES: O=[N+]([O-])c1cccnc1Nc1ccc(F)cc1F
InChIKey: OBRKJIGJUPEPAL-UHFFFAOYSA-N
Molecular formula: C11H7F2N3O2
Average molar mass: 251.19 g/mol
Monoisotopic mass: 251.0506328

Names & identifiers

Preferred name: N-(2,4-Difluorophenyl)-3-nitropyridin-2-amine
IUPAC: N-(2,4-difluorophenyl)-3-nitropyridin-2-amine

Names & synonyms

61963-74-4N-(2,4-Difluorophenyl)-3-nitropyridin-2-amineSCHEMBL11847493DTXSID40498523OBRKJIGJUPEPAL-UHFFFAOYSA-N2-(2,4-difluoroanilino)-3-nitropyridine

Database identifiers

CAS: 61963-74-4
PubChem CID: 12445346
DTXSID: DTXSID40498523

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 70.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 2
Heavy atoms: 18
Formal charge: 0
Complexity: 301

Related reactions

2 records

New reaction record

HRID 807623As productTest data from https://doi.org/10.1039/C8SC04228D

HRID 1974323As productuspto-grants-1976_12

Compound notes

Loading…