Basic information
- Standard SMILES
CCS(=O)(=O)c1ncc(C(F)(F)F)cn1- InChIKey
AOLDZHAGICDJTM-UHFFFAOYSA-N- Molecular formula
- C7H7F3N2O2S
- Average molar mass
- 240.21 g/mol
- Monoisotopic mass
- 240.01803313
Names & identifiers
- Preferred name
- 2-Ethylsulfonyl-5-trifluoromethylpyrimidine
- IUPAC
- 2-ethylsulfonyl-5-(trifluoromethyl)pyrimidine
Names & synonyms
2-Ethylsulfonyl-5-trifluoromethylpyrimidineSCHEMBL10736351
Database identifiers
- PubChem CID
- 13317023
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 301
Related reactions
2 records
Compound notes
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