Basic information
- CAS
87847-83-4- Standard SMILES
COC(=O)c1c(Cl)nc(Cl)nc1Oc1ccccc1- InChIKey
HTVLLYWKPSUPCJ-UHFFFAOYSA-N- Molecular formula
- C12H8Cl2N2O3
- Average molar mass
- 299.11 g/mol
- Monoisotopic mass
- 297.9911975
Names & identifiers
- Preferred name
- Methyl 2,4-dichloro-6-phenoxypyrimidine-5-carboxylate
- IUPAC
- methyl 2,4-dichloro-6-phenoxypyrimidine-5-carboxylate
Names & synonyms
Methyl 2,4-dichloro-6-phenoxypyrimidine-5-carboxylate87847-83-4DTXSID40532971
Database identifiers
- CAS
87847-83-4- PubChem CID
- 13264382
- DTXSID
DTXSID40532971
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 61.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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