Basic information
- CAS
13753-01-0- Standard SMILES
O=C(O)C1=C(C(=O)O)/C=C\C=C/C=C\1- InChIKey
OKRRQQUSUAYNOD-DLMDZQPMSA-N- Molecular formula
- C10H8O4
- Average molar mass
- 192.17 g/mol
- Monoisotopic mass
- 192.04225873
Names & identifiers
- Preferred name
- 1,3,5,7-Cyclooctatetraene-1,2-dicarboxylic acid
- IUPAC
- (1Z,3Z,5Z,7Z)-cycloocta-1,3,5,7-tetraene-1,2-dicarboxylic acid
Names & synonyms
NSC13108113753-01-01,3,5,7-cyclooctatetraene-1,2-dicarboxylic acidDTXSID90419167AKOS024329802NSC-131081
Database identifiers
- CAS
13753-01-0- PubChem CID
- 5382016
- DTXSID
DTXSID90419167
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 347
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…