1,4-Bis[2-[(1-oxo-2-propen-1-yl)oxy]ethyl] butanedioate
Basic information
- CAS
51248-94-3- Standard SMILES
C=CC(=O)OCCOC(=O)CCC(=O)OCCOC(=O)C=C- InChIKey
YSBRONDIFBGIAN-UHFFFAOYSA-N- Molecular formula
- C14H18O8
- Average molar mass
- 314.29 g/mol
- Monoisotopic mass
- 314.10016753
Names & identifiers
- Preferred name
- 1,4-Bis[2-[(1-oxo-2-propen-1-yl)oxy]ethyl] butanedioate
- IUPAC
- bis(2-prop-2-enoyloxyethyl) butanedioate
Names & synonyms
SCHEMBL3035961,4-Bis[2-[(1-oxo-2-propen-1-yl)oxy]ethyl] butanedioateDTXSID00134255451248-94-3
Database identifiers
- CAS
51248-94-3- PubChem CID
- 54524364
- DTXSID
DTXSID001342554- Nikkaji
- J2.157.292F
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 15
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 387
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Compound notes
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