3-Butylcyclopentanone
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Basic information
- Standard SMILES
CCCCC1CCC(=O)C1- InChIKey
OZACSKDSZFGTAY-UHFFFAOYSA-N- Molecular formula
- C9H16O
- Average molar mass
- 140.22 g/mol
Names & identifiers
- Preferred name
- 3-Butylcyclopentanone
- IUPAC
- 3-butylcyclopentan-1-one
Names & synonyms
3-Butylcyclopentanone3-butyl-cyclopentanone3-n-butylcyclopentanone3-Butylcyclopentanone #Cyclopentanone, 3-butyl-3-butyl-cyclopentan-1-oneSCHEMBL2693722SCHEMBL6592508SCHEMBL7739728AKOS013846003
Database identifiers
- PubChem CID
- 557889
- Nikkaji
- J160.200D
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 118
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Related reactions
4 records
Compound notes
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