4-Chloro-6-(3-ethoxyphenyl)pyrimidine
Basic information
- CAS
954223-52-0- Standard SMILES
CCOc1cccc(-c2cc(Cl)ncn2)c1- InChIKey
LLDXAMHVMKFPHD-UHFFFAOYSA-N- Molecular formula
- C12H11ClN2O
- Average molar mass
- 234.68 g/mol
- Monoisotopic mass
- 234.0559907
Names & identifiers
- Preferred name
- 4-Chloro-6-(3-ethoxyphenyl)pyrimidine
- IUPAC
- 4-chloro-6-(3-ethoxyphenyl)pyrimidine
Names & synonyms
954223-52-0SCHEMBL4438481DTXSID801288368AKOS0175531714-chloro-6-(3-ethoxyphenyl)pyrimidine
Database identifiers
- CAS
954223-52-0- PubChem CID
- 24902181
- DTXSID
DTXSID801288368
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 35 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 215
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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