Basic information
- Standard SMILES
Nc1nc(CCl)cc(OCC(F)(F)F)n1- InChIKey
YPAYMKKUOUWHQD-UHFFFAOYSA-N- Molecular formula
- C7H7ClF3N3O
- Average molar mass
- 241.6 g/mol
- Monoisotopic mass
- 241.022974
Names & identifiers
- Preferred name
- 2-Amino-4-chloromethyl-6-(2,2,2-trifluoroethoxy)pyrimidine
- IUPAC
- 4-(chloromethyl)-6-(2,2,2-trifluoroethoxy)pyrimidin-2-amine
Names & synonyms
2-amino-4-chloromethyl-6-(2,2,2-trifluoroethoxy)pyrimidineSCHEMBL10618273
Database identifiers
- PubChem CID
- 20153493
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 61 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 204
Related reactions
2 records
Compound notes
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