4,4-dimethyl-6-[(E)-2-phenylethenyl]-1,3-dihydropyrimidin-2-one
Basic information
- CAS
27656-23-1- Standard SMILES
CC1(C)C=C(/C=C/c2ccccc2)NC(=O)N1- InChIKey
IGIXVEPIBCBDMH-CMDGGOBGSA-N- Molecular formula
- C14H16N2O
- Average molar mass
- 228.29 g/mol
- Monoisotopic mass
- 228.12626314
Names & identifiers
- Preferred name
- 4,4-dimethyl-6-[(E)-2-phenylethenyl]-1,3-dihydropyrimidin-2-one
- IUPAC
- 4,4-dimethyl-6-[(E)-2-phenylethenyl]-1,3-dihydropyrimidin-2-one
Names & synonyms
27656-23-12(1H)-Pyrimidinone, 3,4-dihydro-4,4-dimethyl-6-styryl-, (E)-4,4-dimethyl-6-(2-phenylvinyl)-3,4-dihydro-2(1H)-pyrimidinoneOprea1_285742DTXSID4011839124,4-dimethyl-6-[(E)-2-phenylethenyl]-1,3-dihydropyrimidin-2-oneCCG-110024,4-dimethyl-6-[(E)-2-phenylethenyl]-3,4-dihydropyrimidin-2(1H)-oneAKOS001711502ST088480BIM-0023972.P001AG-205/36696038
Show more names
4,4-dimethyl-6-(2-phenylethenyl)-3,4-dihydropyrimidin-2(1H)-one4-((1E)-2-phenylvinyl)-6,6-dimethyl-1,3,6-trihydropyrimidin-2-one
Database identifiers
- CAS
27656-23-1- PubChem CID
- 684541
- DTXSID
DTXSID401183912
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 349
Related reactions
0 records
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Compound notes
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