Basic information
- CAS
29005-43-4- Standard SMILES
CC1(C)C(=O)NNC1=O- InChIKey
PGBXZDDHDXRVAV-UHFFFAOYSA-N- Molecular formula
- C5H8N2O2
- Average molar mass
- 128.13 g/mol
- Monoisotopic mass
- 128.0585775
Names & identifiers
- Preferred name
- 4,4-Dimethylpyrazolidine-3,5-dione
- IUPAC
- 4,4-dimethylpyrazolidine-3,5-dione
Names & synonyms
4,4-dimethylpyrazolidine-3,5-dione29005-43-43,5-Pyrazolidinedione, 4,4-dimethyl-4,4-dimethyl-3,5-PyrazolidinedioneSCHEMBL992963SCHEMBL993738DTXSID909516184,4-Dimethyl-4H-pyrazole-3,5-diolAKOS040824606DA-22048
Database identifiers
- CAS
29005-43-4- PubChem CID
- 178246
- DTXSID
DTXSID90951618- Nikkaji
- J427.027D
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 58.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 156
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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