2-Chloro-4-[4-(trifluoromethoxy)phenyl]pyrimidine
Basic information
- CAS
954217-67-5- Standard SMILES
FC(F)(F)Oc1ccc(-c2ccnc(Cl)n2)cc1- InChIKey
XWJXIKFHTMNBLW-UHFFFAOYSA-N- Molecular formula
- C11H6ClF3N2O
- Average molar mass
- 274.62 g/mol
Names & identifiers
- Preferred name
- 2-Chloro-4-[4-(trifluoromethoxy)phenyl]pyrimidine
- IUPAC
- 2-chloro-4-[4-(trifluoromethoxy)phenyl]pyrimidine
- English name
- 2-Chloro-4-(4-trifluoromethoxy-phenyl)-pyrimidine
- Molecular formula
- C11H6ClF3N2O
- Molecular weight
- 274.63
Names & synonyms
954217-67-52-chloro-4-[4-(trifluoromethoxy)phenyl]pyrimidine2-chloro-4-(4-(trifluoromethoxy)phenyl)pyrimidineMFCD09861499SCHEMBL14637424AC7445AKOS025211990SB59766SY037175CS-03651982-Chloro-4-(4-trifluoromethoxy-phenyl)-pyrimidinePyrimidine, 2-chloro-4-[4-(trifluoromethoxy)phenyl]-
Database identifiers
- CAS
954217-67-5
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 35 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 270
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Compound notes
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