Basic information
- CAS
1245279-25-7- Standard SMILES
CCOC(=O)c1cnn(-c2ccccc2F)c1Cl- InChIKey
GGDAJHCXTDHSPZ-UHFFFAOYSA-N- Molecular formula
- C12H10ClFN2O2
- Average molar mass
- 268.67 g/mol
- Monoisotopic mass
- 268.0414834
Names & identifiers
- Preferred name
- Ethyl 5-chloro-1-(2-fluorophenyl)-1H-pyrazole-4-carboxylate
- IUPAC
- ethyl 5-chloro-1-(2-fluorophenyl)pyrazole-4-carboxylate
- English name
- ethyl 5-chloro-1-(2-fluorophenyl)-1H-pyrazole-4-carboxylate
- Molecular formula
- C12H10ClFN2O2
- Molecular weight
- 268.67
Names & synonyms
1245279-25-7ETHYL 5-CHLORO-1-(2-FLUOROPHENYL)-1H-PYRAZOLE-4-CARBOXYLATEethyl 5-chloro-1-(2-fluorophenyl)pyrazole-4-carboxylateDTXSID40700133ethyl5-chloro-1-(2-fluorophenyl)-1H-pyrazole-4-carboxylateAKOS022172728DB-062269Ethyl 5-chloro-1-(2-fluorophenyl);-1H-pyrazole-4-carboxylate1H-Pyrazole-4-carboxylic acid, 5-chloro-1-(2-fluorophenyl)-, ethyl ester
Database identifiers
- CAS
1245279-25-7- PubChem CID
- 53429366
- DTXSID
DTXSID40700133
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 306
Chemistry & industry
Suppliers1 total
ARENA CHEMICAL[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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