Basic information
- CAS
306960-72-5- Standard SMILES
CCc1nc(Cl)ncc1C(=O)Cl- InChIKey
QEKLNADXCCMCCZ-UHFFFAOYSA-N- Molecular formula
- C7H6Cl2N2O
- Average molar mass
- 205.04 g/mol
- Monoisotopic mass
- 203.9857182
Names & identifiers
- Preferred name
- 2-Chloro-4-ethyl-5-pyrimidinecarbonyl chloride
- IUPAC
- 2-chloro-4-ethylpyrimidine-5-carbonyl chloride
- English name
- 5-Pyrimidinecarbonyl chloride, 2-chloro-4-ethyl- (9CI)
- Molecular formula
- C7H6Cl2N2O
- Molecular weight
- 205.04
Names & synonyms
306960-72-52-chloro-4-ethylpyrimidine-5-carbonyl chloride2-CHLORO-4-ETHYL-5-PYRIMIDINECARBONYL CHLORIDESCHEMBL3056042DTXSID304447112-chloro-4-ethylpyrimidine-5-carbonylchloride5-Pyrimidinecarbonyl chloride, 2-chloro-4-ethyl-5-Pyrimidinecarbonyl chloride, 2-chloro-4-ethyl- (9CI)
Database identifiers
- CAS
306960-72-5- PubChem CID
- 10774591
- DTXSID
DTXSID30444711
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 42.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 177
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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