Bis[4-(oxolan-2-yl)butan-2-yl] nonanedioate
Basic information
- CAS
7702-52-5- Standard SMILES
CC(CCC1CCCO1)OC(=O)CCCCCCCC(=O)OC(C)CCC1CCCO1- InChIKey
NCHOJZHFMFWTMB-UHFFFAOYSA-N- Molecular formula
- C25H44O6
- Average molar mass
- 440.6 g/mol
- Monoisotopic mass
- 440.31378912
Names & identifiers
- Preferred name
- Bis[4-(oxolan-2-yl)butan-2-yl] nonanedioate
- IUPAC
- bis[4-(oxolan-2-yl)butan-2-yl] nonanedioate
Names & synonyms
7702-52-5bis[4-(oxolan-2-yl)butan-2-yl] nonanedioateNSC407922DTXSID90324883NSC-407922
Database identifiers
- CAS
7702-52-5- PubChem CID
- 348545
- DTXSID
DTXSID90324883
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 18
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 464
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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