Basic information
- Standard SMILES
COc1ccc(F)c(N=C=O)c1- InChIKey
AUSGZUSFZWKICY-UHFFFAOYSA-N- Molecular formula
- C8H6FNO2
- Average molar mass
- 167.14 g/mol
Names & identifiers
- Preferred name
- 1-Fluoro-2-isocyanato-4-methoxybenzene
- IUPAC
- 1-fluoro-2-isocyanato-4-methoxybenzene
Names & synonyms
1-fluoro-2-isocyanato-4-methoxybenzeneSCHEMBL4047507AUSGZUSFZWKICY-UHFFFAOYSA-N2-fluoro-5-methoxyphenyl isocyanateAKOS018782417143876-16-8DB-180826
Database identifiers
- PubChem CID
- 22150993
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 191
Related reactions
4 records
Compound notes
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