2-Butylpyrazolidin-3-one
Basic information
- CAS
101325-23-9- Standard SMILES
CCCCN1NCCC1=O- InChIKey
BXPVMYPTRXRXEI-UHFFFAOYSA-N- Molecular formula
- C7H14N2O
- Average molar mass
- 142.2 g/mol
- Monoisotopic mass
- 142.11061307
Names & identifiers
- Preferred name
- 2-Butylpyrazolidin-3-one
- IUPAC
- 2-butylpyrazolidin-3-one
Names & synonyms
2-butylpyrazolidin-3-one3-Pyrazolidinone, 2-butyl-DTXSID601311020101325-23-9
Database identifiers
- CAS
101325-23-9- PubChem CID
- 85524927
- DTXSID
DTXSID601311020
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 125
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Compound notes
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