Basic information
- CAS
469-92-1- Standard SMILES
CC1(C)C=C[C@@]23CCC[C@@](C)(CC[C@@H]12)C3- InChIKey
MKZIRHIVARSBHI-AEGPPILISA-N- Molecular formula
- C15H24
- Average molar mass
- 204.35 g/mol
- Monoisotopic mass
- 204.18780077
Overview
CID 10102 has been reported in Pulicaria arabica and Arctium lappa with data available.
Names & identifiers
- Preferred name
- Clovene
- IUPAC
- (1S,5S,8S)-4,4,8-trimethyltricyclo[6.3.1.01,5]dodec-2-ene
- English name
- (-)-Clovene
- Molecular formula
- C15H24
- Molecular weight
- 204.35
Names & synonyms
CLOVENE469-92-1DTXSID10963697RefChem:1082037DTXCID1013914354,4,8-trimethyltricyclo(6.3.1.01,5)dodec-2-ene(1S,5S,8S)-4,4,8-Trimethyltricyclo[6.3.1.01,5]dodec-2-ene(3as,7s,9as)-1,1,7-trimethyl-1,4,5,6,7,8,9,9a-octahydro-3a,7-methanocyclopenta[8]annulene1,1,7-Trimethyl-1,4,5,6,7,8,9,9a-octahydro-3a,7-methanocyclopenta[8]annuleneCloven(-)-Clovene(-)-Clovene technical, >=90% (sum of enantiomers, GC)
Show more names
3a,7-Methano-3aH-cyclopentacyclooctene, 1,4,5,6,7,8,9,9a-octahydro-1,1,7beta-trimethyl-(3aR)-1,4,5,6,7,8,9,9aα-Octahydro-3aβ,7β-methano-1,1,7-trimethyl-3aH-cyclopentacyclooctene(3aR,9aα)-1,4,5,6,7,8,9,9a-Octahydro-1,1,7-trimethyl-3aβ,7β-methano-3aH-cyclopentacyclooctene3a,7-Methano-3aH-cyclopentacyclooctene, 1,4,5,6,7,8,9,9a-octahydro-1,1,7-trimethyl-, (3aR,7R,9aS)-3a,7-Methano-3aH-cyclopentacyclooctene, 1,4,5,6,7,8,9,9a-octahydro-1,1,7-trimethyl-, [3aR-(3aalpha,7alpha,9abeta)]-
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 312
Physicochemical properties
- Boiling point
- 259 · 259-260 °C
- Density
- 0.9241 g/cm3 · 0.9241 g/cm3(Temp: 18 °C)
- refractive index
- 20 · n20/D 1.495
- storage temp.
- 2 · 2-8°C
- optical activity
- 20 · [α]20/D 27.5±1°, c = 1% in chloroform
- BRN
- 2044272 · 2044272
- Safety Statements
- 23 · 23-24/25
- WGK Germany
- 3 · 3
- F
- 10 · 10-23
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- F
- 10-23
- wgk
- 3
- safety_code
- 23-24/25
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers3 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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