Basic information
- Standard SMILES
Cc1cc([N+](=O)[O-])cc(C)c1Oc1ccc(O)c(Cc2ccc(F)cc2)c1- InChIKey
ZFJAHLUXBRXJAS-UHFFFAOYSA-N- Molecular formula
- C21H18FNO4
- Average molar mass
- 367.4 g/mol
Names & identifiers
- Preferred name
- 2-[(4-Fluorophenyl)methyl]-4-(2,6-dimethyl-4-nitrophenoxy)phenol
- IUPAC
- 4-(2,6-dimethyl-4-nitrophenoxy)-2-[(4-fluorophenyl)methyl]phenol
Names & synonyms
SCHEMBL8799407ZFJAHLUXBRXJAS-UHFFFAOYSA-N2-[(4-fluorophenyl)methyl]-4-(2,6-dimethyl-4-nitrophenoxy)phenol
Database identifiers
- PubChem CID
- 19030100
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 479
Related reactions
4 records
Compound notes
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