Basic information
- Standard SMILES
CCCCOC(=O)c1ccc(OC(=O)c2ccc(C(=O)Oc3ccc(C(=O)OCCCC)cc3)cc2)cc1- InChIKey
WFFPGIHJHIWXQE-UHFFFAOYSA-N- Molecular formula
- C30H30O8
- Average molar mass
- 518.6 g/mol
- Monoisotopic mass
- 518.19406791
Names & identifiers
- Preferred name
- Di(p-butoxycarbonylphenyl)terephthalate
- IUPAC
- bis(4-butoxycarbonylphenyl) benzene-1,4-dicarboxylate
Names & synonyms
SCHEMBL10344348WFFPGIHJHIWXQE-UHFFFAOYSA-NAKOS003473706di(p-butoxycarbonylphenyl)terephthalate
Database identifiers
- PubChem CID
- 4933464
- Nikkaji
- J950.394C
Properties
Computed structural properties
- XLogP
- 8.4
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 16
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 692
Related reactions
1 records
Compound notes
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