Basic information
- CAS
21299-15-0- Standard SMILES
CCOC(=O)C(CC(C(=O)OCC)C(=O)c1ccccc1)C(=O)c1ccccc1- InChIKey
FWWMZWILXXJXAE-UHFFFAOYSA-N- Molecular formula
- C23H24O6
- Average molar mass
- 396.4 g/mol
- Monoisotopic mass
- 396.15728848
Names & identifiers
- Preferred name
- Diethyl 2,4-dibenzoylpentanedioate
- IUPAC
- diethyl 2,4-dibenzoylpentanedioate
- English name
- Pentanedioic acid, 2,4-dibenzoyl-, 1,5-diethyl ester
- Molecular formula
- C23H24O6
- Molecular weight
- 396.43
Names & synonyms
diethyl 2,4-dibenzoylpentanedioate21299-15-0DTXSID80301027RefChem:337771DTXCID80252161NSC140612Pentanedioic acid, 2,4-dibenzoyl-, 1,5-diethyl esterNSC-140612DS-000595
Database identifiers
- CAS
21299-15-0- PubChem CID
- 284589
- DTXSID
DTXSID80301027- Nikkaji
- J2.769.696A
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 86.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 522
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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