2-Propenal, 3-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-
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Basic information
- CAS
55759-91-6- Standard SMILES
CC1(C)CCCC2(C)OC12C=CC=O- InChIKey
GWLZALBEUUMVQS-UHFFFAOYSA-N- Molecular formula
- C12H18O2
- Average molar mass
- 194.27 g/mol
- Monoisotopic mass
- 194.13067981
Names & identifiers
- Preferred name
- 2-Propenal, 3-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-
- IUPAC
- 3-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)prop-2-enal
- English name
- 2-Propenal,3-(2,2,6-trimet
- Molecular formula
- C12H18O2
- Molecular weight
- 194.27
Names & synonyms
55759-91-62-Propenal, 3-(2,2,6-trimethyl-7-oxabicyclo(4.1.0)hept-1-yl)-2-Propenal, 3-(2,2,6-trimethyl-7-oxabicyclo[4.1.0]hept-1-yl)-RefChem:266181DTXSID309711383-(2,2,6-Trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl)prop-2-enal2-Propenal,3-(2,2,6-trimet3-(2,2,6-Trimethyl-7-oxabicyclo[4.1.0]heptane-1-yl)propenal
Database identifiers
- CAS
55759-91-6- PubChem CID
- 108359
- DTXSID
DTXSID30971138
Properties
Computed structural propertiesFilling in
- XLogP
- 1.8
- Topological polar surface area
- 29.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 293
Related reactions
0 records
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Compound notes
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