Tetramethyl [1,1'-biphenyl]-2,2',6,6'-tetracarboxylate
Basic information
- CAS
52657-21-3- Standard SMILES
COC(=O)c1cccc(C(=O)OC)c1-c1c(C(=O)OC)cccc1C(=O)OC- InChIKey
DOCYRKPSQYKQIU-UHFFFAOYSA-N- Molecular formula
- C20H18O8
- Average molar mass
- 386.4 g/mol
- Monoisotopic mass
- 386.10016753
Names & identifiers
- Preferred name
- Tetramethyl [1,1'-biphenyl]-2,2',6,6'-tetracarboxylate
- IUPAC
- dimethyl 2-[2,6-bis(methoxycarbonyl)phenyl]benzene-1,3-dicarboxylate
Names & synonyms
52657-21-3NSC74935NCIOpen2_009067DTXSID60328974Tetramethyl [1,1'-biphenyl]-2,2',6,6'-tetracarboxylateDOCYRKPSQYKQIU-UHFFFAOYSA-Ndimethyl 2-[2,6-bis(methoxycarbonyl)phenyl]benzene-1,3-dicarboxylateNSC-74935DS-007492Biphenyl-2,2',6,6'-tetracarboxylic acid, tetramethyl esterTetramethyl [1,1'-biphenyl]-2,2',6,6'-tetracarboxylate #
Database identifiers
- CAS
52657-21-3- PubChem CID
- 415998
- DTXSID
DTXSID60328974
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 501
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Compound notes
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