Basic information
- CAS
68479-99-2- Standard SMILES
C=C1CCCC(C)(C)C1CCC(C)OC(C)=O- InChIKey
GGSLLFSSNHTPMO-UHFFFAOYSA-N- Molecular formula
- C15H26O2
- Average molar mass
- 238.37 g/mol
- Monoisotopic mass
- 238.19328007
Names & identifiers
- Preferred name
- Cyclohexanepropanol, alpha,2,2-trimethyl-6-methylene-, 1-acetate
- IUPAC
- 4-(2,2-dimethyl-6-methylidenecyclohexyl)butan-2-yl acetate
- English name
- alpha,2,2-trimethyl-6-methylenecyclohexylpropyl acetate
- Molecular formula
- C15H26O2
- Molecular weight
- 238.37
Names & synonyms
EINECS 270-879-5alpha,2,2-Trimethyl-6-methylene-cyclohexanepropanol, acetateCyclohexanepropanol, .alpha.,2,2-trimethyl-6-methylene-, acetateCyclohexanepropanol, alpha,2,2-trimethyl-6-methylene-, 1-acetateCyclohexanepropanol, alpha,2,2-trimethyl-6-methylene-, acetateRefChem:580606Cyclohexanepropanol, .alpha.,2,2-trimethyl-6-methylene-, 1-acetate68479-99-2alpha,2,2-Trimethyl-6-methylenecyclohexylpropyl acetate4-(2,2-dimethyl-6-methylidenecyclohexyl)butan-2-yl acetateDTXSID5052410SCHEMBL29827602
Show more names
trimethyl-6-methylene cyclohexyl propyl acetatealpha,2,2-trimethyl-6-methylene-cyclohexanepropano acetateCyclohexanepropanol, α,2,2-trimethyl-6-methylene-, 1-acetateAcetic acid [3-(2,2-dimethyl-6-methylenecyclohexyl)-1-methylpropyl] ester
GGSLLFSSNHTPMO-UHFFFAOYSA-NNS00013293
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 291
Physicochemical properties
- Boiling point
- 285.996 · 285.996±9.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.926 · 0.926±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- Cosmetics Ingredients Functions
- PERFUMING
- LogP
- 5.135 · 5.135 (est)
- EPA Substance Registry System
- 2 · Cyclohexanepropanol, .alpha.,2,2-trimethyl-6-methylene-, acetate (68479-99-2)
- 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% (89 of 89) of all reports.
Not Classified
Aggregated GHS information provided per 89 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationChemical: Cyclohexanepropanol, .alpha.,2,2-trimethyl-6-methylene-, acetate
Other Safety InformationIMAP assessments - Cyclohexanepropanol, .alpha.,2,2-trimethyl-6-methylene-, acetate: Human health tier I assessment
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCyclohexanepropanol, .alpha.,2,2-trimethyl-6-methylene-, 1-acetate: INACTIVE
Suppliers1 total
Service Chemical Inc.[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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