5-(2,3-Dimethoxyphenyl)pyrazolidin-3-one
Basic information
- CAS
883837-13-6- Standard SMILES
COc1cccc(C2CC(=O)NN2)c1OC- InChIKey
VZVYUNOCKOJTNT-UHFFFAOYSA-N- Molecular formula
- C11H14N2O3
- Average molar mass
- 222.24 g/mol
- Monoisotopic mass
- 222.10044231
Names & identifiers
- Preferred name
- 5-(2,3-Dimethoxyphenyl)pyrazolidin-3-one
- IUPAC
- 5-(2,3-dimethoxyphenyl)pyrazolidin-3-one
Names & synonyms
5-(2,3-dimethoxyphenyl)pyrazolidin-3-one883837-13-6SCHEMBL5969365AKOS0243316815-(2,3-dimethoxyphenyl)-3-pyrazolidinone
Database identifiers
- CAS
883837-13-6- PubChem CID
- 4054499
- EC Number
- 105-291-9
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 59.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 260
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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