Basic information
- CAS
62247-87-4- Standard SMILES
CCCCC1=CC=CC1- InChIKey
FTFYDDRPCCMKBT-UHFFFAOYSA-N- Molecular formula
- C9H14
- Average molar mass
- 122.21 g/mol
- Monoisotopic mass
- 122.10955045
Names & identifiers
- Preferred name
- n-Butyl cyclopentadiene
- IUPAC
- 1-butylcyclopenta-1,3-diene
Names & synonyms
n-butyl cyclopentadiene62247-87-4DTXSID50275983RefChem:1091636DTXCID30227344butylcyclopentadiene1,3-Cyclopentadiene, 1-butyl1-butylcyclopenta-1,3-dienebutyl-cyclopentadienen-butylcyclopentadieneSCHEMBL284854SCHEMBL337597
Show more names
SCHEMBL2038366SCHEMBL3676889SCHEMBL5083804SCHEMBL9067546SCHEMBL10636382SCHEMBL15533617SCHEMBL22471678
Database identifiers
- CAS
62247-87-4- PubChem CID
- 102598
- DTXSID
DTXSID50275983- Nikkaji
- J798.383B
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 129
Related reactions
15 records
Compound notes
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