Bis(6,6-dimethyl-7-bicyclo[3.2.0]heptanyl) but-2-enedioate
Basic information
- CAS
10433-30-4- Standard SMILES
CC1(C)C2CCCC2C1OC(=O)C=CC(=O)OC1C2CCCC2C1(C)C- InChIKey
MJSIMZYYOHYHTN-UHFFFAOYSA-N- Molecular formula
- C22H32O4
- Average molar mass
- 360.5 g/mol
- Monoisotopic mass
- 360.2300595
Names & identifiers
- Preferred name
- Bis(6,6-dimethyl-7-bicyclo[3.2.0]heptanyl) but-2-enedioate
- IUPAC
- bis(7,7-dimethyl-6-bicyclo[3.2.0]heptanyl) but-2-enedioate
Names & synonyms
10433-30-4bis(6,6-dimethyl-7-bicyclo[3.2.0]heptanyl) but-2-enedioateDTXSID30326048Bis(7,7-dimethylbicyclo[3.2.0]heptan-6-yl) but-2-enedioate
Database identifiers
- CAS
10433-30-4- PubChem CID
- 351771
- DTXSID
DTXSID30326048
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 578
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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