2-(Diethoxyphosphorylmethyl)-1,3-dioxane
Basic information
- CAS
67730-29-4- Standard SMILES
CCOP(=O)(CC1OCCCO1)OCC- InChIKey
FUGGTGAAEQGATH-UHFFFAOYSA-N- Molecular formula
- C9H19O5P
- Average molar mass
- 238.22 g/mol
- Monoisotopic mass
- 238.0970107
Names & identifiers
- Preferred name
- 2-(Diethoxyphosphorylmethyl)-1,3-dioxane
- IUPAC
- 2-(diethoxyphosphorylmethyl)-1,3-dioxane
Names & synonyms
67730-29-42-(diethoxyphosphorylmethyl)-1,3-dioxaneNSC322484Diethyl [(1,3-dioxan-2-yl)methyl]phosphonateSCHEMBL11221537DTXSID203179452-diethyl phosphonomethyl-1,3-dioxanNSC-322484DS-003420
Database identifiers
- CAS
67730-29-4- PubChem CID
- 331333
- DTXSID
DTXSID20317945
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 205
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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