2,7-Biphenylenedicarboxylic acid
Basic information
- CAS
69417-80-7- Standard SMILES
O=C(O)c1ccc2c(c1)-c1cc(C(=O)O)ccc1-2- InChIKey
RLGRVKKAMSZUSJ-UHFFFAOYSA-N- Molecular formula
- C14H8O4
- Average molar mass
- 240.21 g/mol
- Monoisotopic mass
- 240.04225873
Names & identifiers
- Preferred name
- 2,7-Biphenylenedicarboxylic acid
- IUPAC
- biphenylene-2,7-dicarboxylic acid
Names & synonyms
2,7-Biphenylenedicarboxylic acidSCHEMBL68062SCHEMBL68063DTXSID50133848769417-80-7
Database identifiers
- CAS
69417-80-7- PubChem CID
- 22140367
- DTXSID
DTXSID501338487- Nikkaji
- J802.798F
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 342
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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