Acetaldehyde, (3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-
Basic information
- CAS
2226-09-7- Standard SMILES
CC1(C)C(=CC=O)C2CCC1C2- InChIKey
CSUCBYYLYMFEFB-UHFFFAOYSA-N- Molecular formula
- C11H16O
- Average molar mass
- 164.24 g/mol
- Monoisotopic mass
- 164.12011513
Names & identifiers
- Preferred name
- Acetaldehyde, (3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-
- IUPAC
- 2-(3,3-dimethyl-2-bicyclo[2.2.1]heptanylidene)acetaldehyde
Names & synonyms
2226-09-7Acetaldehyde, (3,3-dimethylbicyclo[2.2.1]hept-2-ylidene)-DTXSID80276620(3,3-Dimethylbicyclo[2.2.1]heptan-2-ylidene)acetaldehyde
Database identifiers
- CAS
2226-09-7- PubChem CID
- 172437
- DTXSID
DTXSID80276620
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 237
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Compound notes
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