Basic information
- CAS
63917-25-9- Standard SMILES
C=C(C)COC(=O)COCC(=O)OCC(=C)C- InChIKey
RXNOBJBOWJGYRR-UHFFFAOYSA-N- Molecular formula
- C12H18O5
- Average molar mass
- 242.27 g/mol
- Monoisotopic mass
- 242.11542367
Names & identifiers
- Preferred name
- Diglycolic acid, bis(2-methylallyl) ester
- IUPAC
- 2-methylprop-2-enyl 2-[2-(2-methylprop-2-enoxy)-2-oxoethoxy]acetate
- English name
- Oxybisacetic acid bis(2-methylallyl) ester
- Molecular formula
- C12H18O5
- Molecular weight
- 242.27
Names & synonyms
Diglycolic acid, bis(2-methylallyl) esterBis(2-methylallyl) diglycolate63917-25-9DTXSID80213671RefChem:338194DTXCID10136162NSC695203bis(2-methylprop-2-en-1-yl) 2,2'-oxydiacetateOxybisacetic acid bis(2-methylallyl) esterCHEMBL1979511Acetic acid, 2,2'-oxybis-, bis(2-methyl-2-propenyl) esterNSC-695203
Show more names
Acetic acid, 2,2'-oxybis-, bis(2-methyl-2-propenyl) ester (9CI)
NCI60_034060DB-3091542-methylallyl 2-[2-(2-methylallyloxy)-2-oxo-ethoxy]acetate
Database identifiers
- CAS
63917-25-9- PubChem CID
- 393372
- DTXSID
DTXSID80213671- ChEMBL
CHEMBL1979511- Nikkaji
- J83.750D
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 276
Physicochemical properties
- CAS DataBase Reference
- 63917 · 63917-25-9
Chemistry & industry
Applications
UsesAgricultural chemical.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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