Basic information
- CAS
2505-06-8- Standard SMILES
CC1CCC=CCC1- InChIKey
ASLRNQBBLPDZET-UHFFFAOYSA-N- Molecular formula
- C8H14
- Average molar mass
- 110.2 g/mol
- Monoisotopic mass
- 110.10955045
Names & identifiers
- Preferred name
- 5-Methylcycloheptene
- IUPAC
- 5-methylcycloheptene
Names & synonyms
5-MethylcyclohepteneCycloheptene, 5-methyl-5-methylcyclohept-1-eneSCHEMBL355142505-06-8SCHEMBL7998066SCHEMBL10772809SCHEMBL10775841DTXSID40334270ASLRNQBBLPDZET-UHFFFAOYSA-N
Database identifiers
- CAS
2505-06-8- PubChem CID
- 520168
- DTXSID
DTXSID40334270- Nikkaji
- J797.740I
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 72
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…