Bis(2-ethylhexyl) 2-(2-methylpropylidene)propanedioate
Basic information
- CAS
5468-27-9- Standard SMILES
CCCCC(CC)COC(=O)C(=CC(C)C)C(=O)OCC(CC)CCCC- InChIKey
GYEUBQXFVPFOOT-UHFFFAOYSA-N- Molecular formula
- C23H42O4
- Average molar mass
- 382.6 g/mol
- Monoisotopic mass
- 382.30830982
Names & identifiers
- Preferred name
- Bis(2-ethylhexyl) 2-(2-methylpropylidene)propanedioate
- IUPAC
- bis(2-ethylhexyl) 2-(2-methylpropylidene)propanedioate
Names & synonyms
5468-27-9bis(2-ethylhexyl) 2-(2-methylpropylidene)propanedioateNSC25383DTXSID00282304NSC-25383Bis(2-ethylhexyl) (2-methylpropylidene)propanedioate
Database identifiers
- CAS
5468-27-9- PubChem CID
- 230463
- DTXSID
DTXSID00282304
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 17
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 406
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Compound notes
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