Basic information
- Standard SMILES
Clc1nccc(-c2cccnc2Cl)n1- InChIKey
AJJAVBGWTHGSQO-UHFFFAOYSA-N- Molecular formula
- C9H5Cl2N3
- Average molar mass
- 226.06 g/mol
- Monoisotopic mass
- 224.9860526
Names & identifiers
- Preferred name
- 2-Chloro-4-(2-chloropyridin-3-yl)pyrimidine
- IUPAC
- 2-chloro-4-(2-chloro-3-pyridinyl)pyrimidine
Names & synonyms
2-chloro-4-(2-chloropyridin-3-yl)pyrimidine870221-39-9SCHEMBL446754AJJAVBGWTHGSQO-UHFFFAOYSA-NCS-38669DB-3300532-chloro-4(2-chloropyridin-3-yl)pyrimidine2-Chloro-3-(2-chloropyrimidin-4-yl)pyridine2-chloro-4-(2-chloro-pyridin-3-yl)pyrimidineA1-08546
Database identifiers
- PubChem CID
- 24901930
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 191
Related reactions
14 records
Compound notes
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