Bis(2-methylpropyl)(2-methylpropylidene)propanedioate
Basic information
- CAS
5468-25-7- Standard SMILES
CC(C)C=C(C(=O)OCC(C)C)C(=O)OCC(C)C- InChIKey
WMFYBCGVCKZTOE-UHFFFAOYSA-N- Molecular formula
- C15H26O4
- Average molar mass
- 270.36 g/mol
- Monoisotopic mass
- 270.18310931
Names & identifiers
- Preferred name
- Bis(2-methylpropyl)(2-methylpropylidene)propanedioate
- IUPAC
- bis(2-methylpropyl) 2-(2-methylpropylidene)propanedioate
Names & synonyms
5468-25-7bis(2-methylpropyl)(2-methylpropylidene)propanedioateNSC25381SCHEMBL15913828DTXSID80282302NSC 25381NSC-25381Bis(2-methylpropyl) (2-methylpropylidene)propanedioate
Database identifiers
- CAS
5468-25-7- PubChem CID
- 230461
- DTXSID
DTXSID80282302
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 301
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Related reactions
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Compound notes
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