Basic information
- CAS
61408-83-1- Standard SMILES
CCCCC(C)(OC)C(=O)CP(=O)(OC)OC- InChIKey
WZAWFKKYWRMNLU-UHFFFAOYSA-N- Molecular formula
- C11H23O5P
- Average molar mass
- 266.27 g/mol
- Monoisotopic mass
- 266.12831083
Names & identifiers
- Preferred name
- Dimethyl (3-methoxy-3-methyl-2-oxoheptyl)phosphonate
- IUPAC
- 1-dimethoxyphosphoryl-3-methoxy-3-methylheptan-2-one
Names & synonyms
61408-83-1Dimethyl (3-methoxy-3-methyl-2-oxoheptyl)phosphonateSCHEMBL10924303DTXSID70512140
Database identifiers
- CAS
61408-83-1- PubChem CID
- 12876504
- DTXSID
DTXSID70512140
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 284
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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