Basic information
- Standard SMILES
ClCCc1c(Cl)ncnc1-c1ccccc1- InChIKey
FAMLSAQEZWTDBL-UHFFFAOYSA-N- Molecular formula
- C12H10Cl2N2
- Average molar mass
- 253.12 g/mol
Names & identifiers
- Preferred name
- 4-Chloro-5-(2-chloroethyl)-6-phenylpyrimidine
- IUPAC
- 4-chloro-5-(2-chloroethyl)-6-phenylpyrimidine
Names & synonyms
4-chloro-5-(2-chloroethyl)-6-phenylpyrimidine1456534-49-8SCHEMBL15270939FAMLSAQEZWTDBL-UHFFFAOYSA-NDA-44434
Database identifiers
- PubChem CID
- 89814596
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 207
Related reactions
2 records
Compound notes
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