Basic information
- CAS
91045-21-5- Standard SMILES
CC1COC(=O)CCCCCCCCC(=O)OC1- InChIKey
LMGYIFXLVIGMHN-UHFFFAOYSA-N- Molecular formula
- C14H24O4
- Average molar mass
- 256.34 g/mol
- Monoisotopic mass
- 256.16745924
Names & identifiers
- Preferred name
- 3-Methyl-1,5-dioxacyclopentadecane-6,15-dione
- IUPAC
- 3-methyl-1,5-dioxacyclopentadecane-6,15-dione
Names & synonyms
3-methyl-1,5-dioxacyclopentadecane-6,15-dione91045-21-51,5-Dioxacyclopentadecane-6,15-dione, 3-methyl-CYCLIC MP-DIOL-SEAOprea1_297516Oprea1_684574SCHEMBL11127614DTXSID60386332STK094502AKOS000621590ST500043554-methyl-2,6-dioxacyclopentadecane-1,7-dione
Show more names
AG-690/11629111BRD-K41415223-001-01-5
Database identifiers
- CAS
91045-21-5- PubChem CID
- 2859639
- DTXSID
DTXSID60386332
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 237
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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