Basic information
- Standard SMILES
N#Cc1ccc(N)c(OC(CF)CF)c1- InChIKey
GVDGTXXPSFJNDP-UHFFFAOYSA-N- Molecular formula
- C10H10F2N2O
- Average molar mass
- 212.2 g/mol
Names & identifiers
- Preferred name
- 4-Amino-3-(2-fluoro-1-fluoromethyl-ethoxy)-benzonitrile
- IUPAC
- 4-amino-3-(1,3-difluoropropan-2-yloxy)benzonitrile
Names & synonyms
SCHEMBL2369343GVDGTXXPSFJNDP-UHFFFAOYSA-N4-Amino-3-(2-fluoro-1-fluoromethyl-ethoxy)-benzonitrile
Database identifiers
- PubChem CID
- 58413351
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 237
Related reactions
2 records
Compound notes
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