6-Fluoro-3-nitro-2-phenylaminobenzonitrile

HCID 68158024
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
N#Cc1c(F)ccc([N+](=O)[O-])c1Nc1ccccc1
InChIKey
HWVZSWCZWWUENQ-UHFFFAOYSA-N
Molecular formula
C13H8FN3O2
Average molar mass
257.22 g/mol

Names & identifiers

Preferred name
6-Fluoro-3-nitro-2-phenylaminobenzonitrile
IUPAC
2-anilino-6-fluoro-3-nitrobenzonitrile

Names & synonyms

SCHEMBL11901901HWVZSWCZWWUENQ-UHFFFAOYSA-N6-Fluoro-3-nitro-2-phenylaminobenzonitrile

Database identifiers

PubChem CID
68158024

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
81.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
19

Related reactions

2 records
New reaction record

Compound notes

Loading…