Basic information
- CAS
35387-23-6- Standard SMILES
C=C(C)C1CCC2(C)CCC=C(C)C2C1- InChIKey
OZQAPQSEYFAMCY-UHFFFAOYSA-N- Molecular formula
- C15H24
- Average molar mass
- 204.35 g/mol
- Monoisotopic mass
- 204.18780077
Overview
selinene has been reported in Ferula ferulaeoides, Zea mays, and other organisms with data available.
Names & identifiers
- Preferred name
- 2-Isopropenyl-4a,8-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene
- IUPAC
- 5,8a-dimethyl-3-prop-1-en-2-yl-2,3,4,4a,7,8-hexahydro-1H-naphthalene
Names & synonyms
2-Isopropenyl-4a,8-dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthaleneRefChem:1063540207297-57-2epi-alpha-Selinene(-)-alpha-Selinene35387-23-6a-selinenea-Eudesmeneepi-a-Selinene7-epi-.alpha.-Selinene7-epi--.alpha.-selineneSCHEMBL3438652
Show more names
OZQAPQSEYFAMCY-UHFFFAOYSA-NDTXSID801359731Naphthalene, 3,4,4a,5,6,7,8,8a-octahydro-7-isopropylene-1,4a-dimethyl-1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethenyl)-naphthalene1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(prop-1-en-2-yl)naphthalene1,4a-dimethyl-7-(1-methylethenyl)-3,4,4a,5,6,7,8,8a-octahydronaphthalenenaphthalene, 1,2,3,4,4a,5,6,8a-octahydro-4a,8-dimethyl-2-(1-methylethenyl)
Database identifiers
- CAS
35387-23-6- PubChem CID
- 10123
- DTXSID
DTXSID801359731- Nikkaji
- J2.375.677C
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 297
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Chemistry & industry
Pharmacology
Cellular LocationsExtracellular
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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