Dimethyl 3-acetyloxytricyclo[4.2.2.02,5]deca-7,9-diene-7,8-dicarboxylate
Basic information
- CAS
27343-00-6- Standard SMILES
COC(=O)C1=C(C(=O)OC)C2C=CC1C1CC(OC(C)=O)C21- InChIKey
YIKPHGGPWWGXSQ-UHFFFAOYSA-N- Molecular formula
- C16H18O6
- Average molar mass
- 306.31 g/mol
- Monoisotopic mass
- 306.11033829
Names & identifiers
- Preferred name
- Dimethyl 3-acetyloxytricyclo[4.2.2.02,5]deca-7,9-diene-7,8-dicarboxylate
- IUPAC
- dimethyl 3-acetyloxytricyclo[4.2.2.02,5]deca-7,9-diene-7,8-dicarboxylate
Names & synonyms
NSC24982027343-00-6DTXSID00330359NSC-2498203-(ACETYLOXY)TRICYCLO[4.2.2.0(2,9-DIENE-7,8-DICARBOXYLIC ACID, DIMETHYL ESTERDimethyl 3-(acetyloxy)tricyclo[4.2.2.0~2,5~]deca-7,9-diene-7,8-dicarboxylate
Database identifiers
- CAS
27343-00-6- PubChem CID
- 429175
- DTXSID
DTXSID00330359
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 602
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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