Basic information
- Standard SMILES
O=C(Cl)OCCc1c(F)cccc1[N+](=O)[O-]- InChIKey
BWMBATIUFZTVSE-UHFFFAOYSA-N- Molecular formula
- C9H7ClFNO4
- Average molar mass
- 247.61 g/mol
- Monoisotopic mass
- 247.0047636
Names & identifiers
- Preferred name
- 2-(2-Fluoro-6-nitrophenyl)ethoxycarbonyl chloride
- IUPAC
- 2-(2-fluoro-6-nitrophenyl)ethyl carbonochloridate
Names & synonyms
SCHEMBL7644528BWMBATIUFZTVSE-UHFFFAOYSA-N2-(2-fluoro-6-nitrophenyl)ethoxycarbonyl chloride
Database identifiers
- PubChem CID
- 19082704
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 72.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 271
Related reactions
2 records
Compound notes
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