Dimethyl (3,3-dimethoxy-2-oxobutyl)phosphonate
Basic information
- CAS
141903-39-1- Standard SMILES
COC(C)(OC)C(=O)CP(=O)(OC)OC- InChIKey
DSRQAAJRGYUVKW-UHFFFAOYSA-N- Molecular formula
- C8H17O6P
- Average molar mass
- 240.19 g/mol
- Monoisotopic mass
- 240.07627526
Names & identifiers
- Preferred name
- Dimethyl (3,3-dimethoxy-2-oxobutyl)phosphonate
- IUPAC
- 1-dimethoxyphosphoryl-3,3-dimethoxybutan-2-one
Names & synonyms
141903-39-1Dimethyl (3,3-dimethoxy-2-oxobutyl)phosphonateDTXSID70567337
Database identifiers
- CAS
141903-39-1- PubChem CID
- 15037751
- DTXSID
DTXSID70567337
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 252
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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