4,6-Bis(1,1-dimethylethyl)-5-[(2-methoxyethoxy)methoxy]-2-pyrimidine carboxaldehyde
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Basic information
- Standard SMILES
COCCOCOc1c(C(C)(C)C)nc(C=O)nc1C(C)(C)C- InChIKey
CJCYKNBLUVGSJE-UHFFFAOYSA-N- Molecular formula
- C17H28N2O4
- Average molar mass
- 324.4 g/mol
Names & identifiers
- Preferred name
- 4,6-Bis(1,1-dimethylethyl)-5-[(2-methoxyethoxy)methoxy]-2-pyrimidine carboxaldehyde
- IUPAC
- 4,6-ditert-butyl-5-(2-methoxyethoxymethoxy)pyrimidine-2-carbaldehyde
Names & synonyms
SCHEMBL9120115CJCYKNBLUVGSJE-UHFFFAOYSA-N4,6-bis (1,1-dimethylethyl)-5-[(2-methoxyethoxy) methoxy]-2-pyrimidine carboxaldehyde4,6-bis(1,1-dimethylethyl)-5-[(2 -methoxyethoxy)methoxy]-2-pyrimidine carboxaldehyde4,6-bis(1,1-dimethylethyl)-5-[(2-methoxyethoxy)methoxy]-2-pyrimidine carboxaldehyde4,6-bis-(1,1-dimethylethyl)-5-[(2-methoxyethoxy)methoxy]-2-pyrimidine carboxaldehyde
Database identifiers
- PubChem CID
- 19922992
Properties
Computed structural propertiesFilling in
- XLogP
- 3.2
- Topological polar surface area
- 70.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 339
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Related reactions
11 records
Compound notes
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