Basic information
- Standard SMILES
Cn1c(C(F)(F)F)cc(=O)n(-c2cc(OC(F)(F)C(F)Cl)c(Cl)cc2F)c1=O- InChIKey
WGUMOTALVGWWCZ-UHFFFAOYSA-N- Molecular formula
- C14H7Cl2F7N2O3
- Average molar mass
- 455.1 g/mol
Names & identifiers
- Preferred name
- 3-[4-chloro-5-(2-chloro-1,1,2-trifluoroethoxy)-2-fluorophenyl]-1-methyl-6-trifluoromethyl-2,4(1H,3H)-pyrimidinedione
- IUPAC
- 3-[4-chloro-5-(2-chloro-1,1,2-trifluoroethoxy)-2-fluorophenyl]-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione
Names & synonyms
3-[4-chloro-5-(2-chloro-1,1,2-trifluoroethoxy)-2-fluorophenyl]-1-methyl-6-trifluoromethyl-2,4(1H,3H)-pyrimidinedioneSCHEMBL10575519
Database identifiers
- PubChem CID
- 20026136
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 49.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 676
Related reactions
2 records
Compound notes
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