Basic information
- CAS
68259-33-6- Standard SMILES
CC(=O)C1CC2=C(C)CC1C(C(C)C)C2- InChIKey
GNALWRWCIFZYEK-UHFFFAOYSA-N- Molecular formula
- C14H22O
- Average molar mass
- 206.32 g/mol
- Monoisotopic mass
- 206.16706532
Names & identifiers
- Preferred name
- Ethanone, 1-(5(or 6)-methyl-7(or 8)-(1-methylethyl)bicyclo(2.2.2)oct-5-en-2-yl)-
- IUPAC
- 1-(5-methyl-7-propan-2-yl-2-bicyclo[2.2.2]oct-4-enyl)ethanone
- English name
- FELVINONE
- Molecular formula
- C14H22O
- Molecular weight
- 206.32
Names & synonyms
68259-33-6Ethanone, 1-(5(or 6)-methyl-7(or 8)-(1-methylethyl)bicyclo(2.2.2)oct-5-en-2-yl)-EINECS 269-524-71-(5(Or 6)-methyl-7(or 8)-(1-methylethyl)bicyclo(2.2.2)oct-5-en-2-yl)ethan-1-oneEthanone, 1-[5(or 6)-methyl-7(or 8)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]-1-[5(or 6)-methyl-7(or 8)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]ethan-1-oneRefChem:592505Ethanone, 1-5(or 6)-methyl-7(or 8)-(1-methylethyl)bicyclo2.2.2oct-5-en-2-yl-269-524-71-(5-methyl-7-propan-2-yl-2-bicyclo[2.2.2]oct-4-enyl)ethanone7- and 8-Acetyl-5-isopropyl-2-methylbicyclo(2.2.2)oct-2-eneSCHEMBL3506515
Show more names
woody octeneFELVINONEethanone,1-[5(or6)-methyl-7(or7(8)-Acetyl-5-isopropyl-2-methylbicyclo[2.2.2]-2-octeneethanone,1-[5(or6)-methyl-7(or8)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]1-[5(or6)-methyl-7(or8)-(1-methylethyl)bicyclo[2.2.2.]oct-5-en-2-yl]-Ethanone
DTXSID60867555GNALWRWCIFZYEK-UHFFFAOYSA-NNS000127221-[5-METHYL-7-(PROPAN-2-YL)BICYCLO[2.2.2]OCT-4-EN-2-YL]ETHAN-1-ONE
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 311
Experimental & physicochemical properties
FragrancesFragrance Ingredient (1-[5(Or 6)-Methyl-7(or 8)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]ethan-1-one) -> IFRA transparency List
Physicochemical properties
- Odor
- 100 % · at 100.00 %. woody clean spicy balsam
- Odor Type
- woody
- Cosmetics Ingredients Functions
- PERFUMING
- LogP
- 3.688 · 3.688 (est)
- EPA Substance Registry System
- 1 · Ethanone, 1-[5(or 6)-methyl-7(or 8)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]- (68259-33-6)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (1545 of 1545) of all reports.
Not Classified
Aggregated GHS information provided per 1545 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Ethanone, 1-[5(or 6)-methyl-7(or 8)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]-
Ethanone, 1-5(or 6)-methyl-7(or 8)-(1-methylethyl)bicyclo2.2.2oct-5-en-2-yl-: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Ethanone, 1-[5(or 6)-methyl-7(or 8)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]-: Human health tier I assessment
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
Use ClassificationFragrance Ingredients
General Manufacturing InformationEthanone, 1-[5(or 6)-methyl-7(or 8)-(1-methylethyl)bicyclo[2.2.2]oct-5-en-2-yl]-: ACTIVE
Suppliers2 total
BOC Sciences[email protected]
武汉柔博医药化工有限公司027-027-87827088 18986164924 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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