Basic information
- CAS
51608-13-0- Standard SMILES
CC(C)=C1CCC2=CCCC(C)C2(C)C1- InChIKey
USADAYYQBBHRCI-UHFFFAOYSA-N- Molecular formula
- C15H24
- Average molar mass
- 204.35 g/mol
- Monoisotopic mass
- 204.18780077
Overview
Einecs 257-317-4 has been reported in Valeriana officinalis with data available.
Names & identifiers
- Preferred name
- cis-1,2,3,5,6,7,8,8a-Octahydro-1,8a-dimethyl-7-(1-methylethylidene)naphthalene
- IUPAC
- 1,8a-dimethyl-7-propan-2-ylidene-1,2,3,5,6,8-hexahydronaphthalene
Names & synonyms
51608-13-0cis-1,2,3,5,6,7,8,8a-Octahydro-1,8a-dimethyl-7-(1-methylethylidene)naphthaleneEINECS 257-317-4Eremophila-1(10),7(11)-dieneSCHEMBL11822871DTXSID101377005
Database identifiers
- CAS
51608-13-0- PubChem CID
- 103501
- DTXSID
DTXSID101377005- EC Number
- 257-317-4
- Nikkaji
- J2.375.590D
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 315
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…