Pinacolyl dimethylphosphinate
Basic information
- CAS
92411-69-3- Standard SMILES
CC(OP(C)(C)=O)C(C)(C)C- InChIKey
YETUOGDVNMBLAI-UHFFFAOYSA-N- Molecular formula
- C8H19O2P
- Average molar mass
- 178.21 g/mol
- Monoisotopic mass
- 178.11226684
Names & identifiers
- Preferred name
- Pinacolyl dimethylphosphinate
- IUPAC
- 3-dimethylphosphoryloxy-2,2-dimethylbutane
- English name
- pinacolyl dimethylphosphinate
- Molecular formula
- C8H19O2P
- Molecular weight
- 178.21
Names & synonyms
1,2,2-Trimethylpropyl dimethylphosphinatePDMPAPinacolyl dimethylphosphinate92411-69-3RefChem:1742963,3-dimethylbutan-2-yl dimethylphosphinatepinacolyl dimethyl-phosphinateSCHEMBL30087321DTXSID40919187YETUOGDVNMBLAI-UHFFFAOYSA-NPhosphinic acid, dimethyl-, 1,2,2-trimethylpropyl ester1,2,2-TRIMETHYLPROPYLDIMETHYLPHOSPHINATE
Show more names
Phosphinic acid, dimethyl-, 1,2,2-trimethylpropyl ester (9CI)
Database identifiers
- CAS
92411-69-3- PubChem CID
- 119152
- DTXSID
DTXSID40919187- Nikkaji
- J534.958C
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 163
Experimental & physicochemical properties
LogP1.08
Physicochemical properties
- Boiling point
- 202.8 · 202.8±23.0 °C(Predicted)
- Density
- 0.93 · 0.930±0.06 g/cm3(Predicted)
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Related reactions
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Compound notes
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