Basic information
- CAS
278792-85-1- Standard SMILES
CC(=O)C1=C(C)NC(=O)C1C- InChIKey
CZHSEUAKXMZRGH-UHFFFAOYSA-N- Molecular formula
- C8H11NO2
- Average molar mass
- 153.18 g/mol
Names & identifiers
- Preferred name
- 4-Acetyl-3,5-dimethyl-1H-pyrrol-2(3H)-one
- IUPAC
- 4-acetyl-3,5-dimethyl-1,3-dihydropyrrol-2-one
- English name
- 2H-Pyrrol-2-one, 4-acetyl-1,3-dihydro-3,5-dimethyl- (9CI)
- Molecular formula
- C8H11NO2
- Molecular weight
- 153.18
Names & synonyms
278792-85-14-Acetyl-3,5-dimethyl-1H-pyrrol-2(3H)-oneSCHEMBL31464206DB-2819612H-PYRROL-2-ONE, 4-ACETYL-1,3-DIHYDRO-3,5-DIMETHYL-2H-Pyrrol-2-one, 4-acetyl-1,3-dihydro-3,5-dimethyl- (9CI)
Database identifiers
- CAS
278792-85-1- Nikkaji
- J1.303.708F
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 253
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…