Basic information
- CAS
16582-99-3- Standard SMILES
N#Cc1c(N)c(F)c(F)c(F)c1F- InChIKey
IQLNTAINVXUGDV-UHFFFAOYSA-N- Molecular formula
- C7H2F4N2
- Average molar mass
- 190.1 g/mol
- Monoisotopic mass
- 190.01541094
Names & identifiers
- Preferred name
- 2-Aminotetrafluorobenzonitrile
- IUPAC
- 2-amino-3,4,5,6-tetrafluorobenzonitrile
Names & synonyms
2-Aminotetrafluorobenzonitrile16582-99-32-amino-3,4,5,6-tetrafluorobenzonitrileAnthranilonitrile, 3,4,5,6-tetrafluoro-SCHEMBL5155293DTXSID10937131IQLNTAINVXUGDV-UHFFFAOYSA-N
Database identifiers
- CAS
16582-99-3- PubChem CID
- 21731997
- DTXSID
DTXSID10937131- Nikkaji
- J1.581.924C
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 238
Related reactions
2 records
Compound notes
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