Trimethyl 5-(biphenyl-4-yl)-1-cyclohexyl-1h-pyrrole-2,3,4-tricarboxylate
Basic information
- CAS
23230-36-6- Standard SMILES
COC(=O)c1c(C(=O)OC)c(-c2ccc(-c3ccccc3)cc2)n(C2CCCCC2)c1C(=O)OC- InChIKey
OJXADSAKLMTMDZ-UHFFFAOYSA-N- Molecular formula
- C28H29NO6
- Average molar mass
- 475.5 g/mol
- Monoisotopic mass
- 475.19948764
Names & identifiers
- Preferred name
- Trimethyl 5-(biphenyl-4-yl)-1-cyclohexyl-1h-pyrrole-2,3,4-tricarboxylate
- IUPAC
- trimethyl 1-cyclohexyl-5-(4-phenylphenyl)pyrrole-2,3,4-tricarboxylate
Names & synonyms
23230-36-6trimethyl 5-(biphenyl-4-yl)-1-cyclohexyl-1h-pyrrole-2,3,4-tricarboxylateNSC150300DTXSID20302336NSC-150300Trimethyl 5-([1,1'-biphenyl]-4-yl)-1-cyclohexyl-1H-pyrrole-2,3,4-tricarboxylate
Database identifiers
- CAS
23230-36-6- PubChem CID
- 288928
- DTXSID
DTXSID20302336
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 736
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…