Basic information
- Standard SMILES
CC(C)Cc1ccc(-c2ccnc(Cl)n2)cc1- InChIKey
FYFICBSNIUWXRN-UHFFFAOYSA-N- Molecular formula
- C14H15ClN2
- Average molar mass
- 246.73 g/mol
- Monoisotopic mass
- 246.0923762
Names & identifiers
- Preferred name
- 2-Chloro-4-(4-isobutyl-phenyl)-pyrimidine
- IUPAC
- 2-chloro-4-[4-(2-methylpropyl)phenyl]pyrimidine
Names & synonyms
2-Chloro-4-(4-isobutylphenyl)pyrimidine2-Chloro-4-(4-isobutyl-phenyl)-pyrimidineSCHEMBL3400986FYFICBSNIUWXRN-UHFFFAOYSA-N859517-24-1
Database identifiers
- PubChem CID
- 24901983
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 224
Related reactions
6 records
Compound notes
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