N-(3-chloro-4-fluorophenyl)formamide
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Basic information
- CAS
770-22-9- Standard SMILES
O=CNc1ccc(F)c(Cl)c1- InChIKey
UMNSHOMWXHZGSV-UHFFFAOYSA-N- Molecular formula
- C7H5ClFNO
- Average molar mass
- 173.57 g/mol
- Monoisotopic mass
- 173.00436968
Names & identifiers
- Preferred name
- N-(3-chloro-4-fluorophenyl)formamide
- IUPAC
- N-(3-chloro-4-fluorophenyl)formamide
Names & synonyms
N-(3-chloro-4-fluorophenyl)formamide770-22-9NSC 40548NSC40548SCHEMBL90481SCHEMBL7497080SCHEMBL19632330DTXSID60285114UMNSHOMWXHZGSV-UHFFFAOYSA-NNSC-40548AKOS014323886
Database identifiers
- CAS
770-22-9- PubChem CID
- 237238
- DTXSID
DTXSID60285114- Nikkaji
- J2.781.216C
Properties
Computed structural propertiesFilling in
- XLogP
- 1.9
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 144
Related reactions
4 records
Compound notes
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