Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-
Basic information
- CAS
2226-05-3- Standard SMILES
CC1(C)C(=CCO)C2CCC1C2- InChIKey
JGDHOHFQJJATNG-UHFFFAOYSA-N- Molecular formula
- C11H18O
- Average molar mass
- 166.26 g/mol
- Monoisotopic mass
- 166.13576519
Names & identifiers
- Preferred name
- Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-
- IUPAC
- 2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)ethanol
- English name
- delta-2, beta-Norbornane ethanol, 3,3-dimethyl
- Molecular formula
- C11H18O
- Molecular weight
- 166.26
Names & synonyms
2226-05-32-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)ethanolEthanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-SCHEMBL3021316DTXSID70862879JGDHOHFQJJATNG-UHFFFAOYSA-NNS000836952-(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)ethan-1-olPATCHOMINTDL-PATCHENOLpatchouli ethanoldelta-2, beta-Norbornane ethanol, 3,3-dimethyl
Show more names
2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)ethanolEthanol, 2-(3,3-dimethylbicyclo2.2.1hept-2-ylidene)-
Database identifiers
- CAS
2226-05-3- PubChem CID
- 94046
- DTXSID
DTXSID70862879- EC Number
- 218-755-1
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 215
Physicochemical properties
- Boiling point
- 114 · 114-116 °C(Press: 6-7 Torr)
- Density
- 1.049 · 1.049±0.06 g/cm3(Predicted)
- pka
- 14.74 · 14.74±0.10(Predicted)
- Odor
- 100 % · at 100.00 %. dry sawdust woody patchouli camphor mint
- Odor Type
- woody
- Cosmetics Ingredients Functions
- PERFUMING
- LogP
- 3.22 · 3.220 (est)
- EPA Substance Registry System
- 2 · Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)- (2226-05-3)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
- 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
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 89 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory Information
Chemical: Ethanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-
Ethanol, 2-(3,3-dimethylbicyclo2.2.1hept-2-ylidene)-: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationEthanol, 2-(3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-: ACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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