Basic information
- Standard SMILES
CC(C)CCOc1cc(Cl)nc(C(C)C)n1- InChIKey
WIQJKCJMGSCPND-UHFFFAOYSA-N- Molecular formula
- C12H19ClN2O
- Average molar mass
- 242.74 g/mol
- Monoisotopic mass
- 242.1185909
Names & identifiers
- Preferred name
- 6-Chloro-4-(3-methylbut-1-oxy)-2-i-propylpyrimidine
- IUPAC
- 4-chloro-6-(3-methylbutoxy)-2-propan-2-ylpyrimidine
Names & synonyms
SCHEMBL8387577WIQJKCJMGSCPND-UHFFFAOYSA-NAKOS0195178746-chloro-4-(3-methylbut-1-oxy)-2-i-propylpyrimidine
Database identifiers
- PubChem CID
- 19006795
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 35 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 199
Related reactions
1 records
Compound notes
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