Basic information
- CAS
20728-03-4- Standard SMILES
CC(C=O)CC1CC2CCC1C2- InChIKey
JZAUTFKKORTMPS-UHFFFAOYSA-N- Molecular formula
- C11H18O
- Average molar mass
- 166.26 g/mol
- Monoisotopic mass
- 166.13576519
Names & identifiers
- Preferred name
- Bicyclo(2.2.1)heptane-2-propanal, alpha-methyl-
- IUPAC
- 3-(2-bicyclo[2.2.1]heptanyl)-2-methylpropanal
- English name
- alpha-methylbicyclo[2.2.1]heptane-2-propionaldehyde
- Molecular formula
- C11H18O
- Molecular weight
- 166.26
Names & synonyms
EINECS 243-992-2Bicyclo[2.2.1]heptane-2-propanal, .alpha.-methyl-DTXSID10885148Bicyclo(2.2.1)heptane-2-propanal, alpha-methyl-Bicyclo[2.2.1]heptane-2-propanal, alpha-methyl-RefChem:568163DTXCID40102454620728-03-4alpha-Methylbicyclo[2.2.1]heptane-2-propanalalpha-methylbicyclo[2.2.1]heptane-2-propionaldehydealpha-Methylbicyclo(2.2.1)heptane-2-propionaldehyde3-(bicyclo[2.2.1]heptan-2-yl)-2-methylpropanal
Show more names
α-Methylbicyclo[2.2.1]heptane-2-propanalBicyclo[2.2.1]heptane-2-propanal, α-methyl-
JZAUTFKKORTMPS-UHFFFAOYSA-NNS00050223
Database identifiers
- CAS
20728-03-4- PubChem CID
- 89375
- DTXSID
DTXSID10885148- EC Number
- 243-992-2
- Nikkaji
- J225.316J
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 176
Physicochemical properties
- EPA Substance Registry System
- 2.2 · Bicyclo[2.2.1]heptane-2-propanal, .alpha.-methyl- (20728-03-4)
- 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.
Hazard information
Regulatory InformationChemical: Bicyclo[2.2.1]heptane-2-propanal, .alpha.-methyl-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBicyclo[2.2.1]heptane-2-propanal, .alpha.-methyl-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…