dimethylphosphinic acid;dimethylphosphorylmethane;methane

C6H20O3P2 — CID 161015324

IUPACdimethylphosphinic acid;dimethylphosphorylmethane;methane
SMILESC.CP(C)(=O)O.CP(C)(C)=O
InChIInChI=1S/C3H9OP.C2H7O2P.CH4/c2*1-5(2,3)4;/h1-3H3;1-2H3,(H,3,4);1H4
InChIKeyTXQLISJZQWVYFO-UHFFFAOYSA-N
MW202.17 g/mol
LogP2.39
Rot. Bonds

About dimethylphosphinic acid;dimethylphosphorylmethane;methane

dimethylphosphinic acid;dimethylphosphorylmethane;methane (PubChem CID 161015324) has the molecular formula C6H20O3P2 and a molecular weight of 202.17 g/mol. Its IUPAC name is dimethylphosphinic acid;dimethylphosphorylmethane;methane.

Molecular Properties

Compound Namedimethylphosphinic acid;dimethylphosphorylmethane;methane
PubChem CID161015324
Molecular FormulaC6H20O3P2
Molecular Weight202.17 g/mol
Exact Mass202.09
IUPAC Namedimethylphosphinic acid;dimethylphosphorylmethane;methane
SMILESC.CP(C)(=O)O.CP(C)(C)=O
InChIInChI=1S/C3H9OP.C2H7O2P.CH4/c2*1-5(2,3)4;/h1-3H3;1-2H3,(H,3,4);1H4
InChIKeyTXQLISJZQWVYFO-UHFFFAOYSA-N
XLogP2.39
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.17
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

dimethylphosphinic acid;ethene
CID 159258868
bis(dimethylphosphinic acid);platinum
CID 58918492
dimethylphosphinic acid;hydroxy-dimethyl-sulfanylidene-λ5-phosphane;methane;methylphosphonic acid
CID 159434045
methylphosphonic acid;uranium
CID 174844261
methylphosphonic acid;dihydrochloride
CID 87344491
methane;phosphoric acid
CID 173400304
dimethylphosphorylmethane;hydron
CID 139251377
methane;phosphoric acid
CID 18515646
sodium;carbanide;methylphosphonic acid
CID 157106296
butane-1,4-diol;bis(dimethylphosphinic acid)
CID 87843342
azane;methane;phosphoric acid
CID 174060347
aminophosphonic acid;methylphosphonic acid
CID 87311898

Frequently Asked Questions

What is the IUPAC name of dimethylphosphinic acid;dimethylphosphorylmethane;methane?
The IUPAC name of dimethylphosphinic acid;dimethylphosphorylmethane;methane (CID 161015324) is dimethylphosphinic acid;dimethylphosphorylmethane;methane.
What is the SMILES notation for dimethylphosphinic acid;dimethylphosphorylmethane;methane?
The canonical SMILES for dimethylphosphinic acid;dimethylphosphorylmethane;methane is C.CP(C)(=O)O.CP(C)(C)=O.
What is the InChIKey of dimethylphosphinic acid;dimethylphosphorylmethane;methane?
The InChIKey is TXQLISJZQWVYFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9OP.C2H7O2P.CH4/c2*1-5(2,3)4;/h1-3H3;1-2H3,(H,3,4);1H4.
What are the key properties of dimethylphosphinic acid;dimethylphosphorylmethane;methane?
dimethylphosphinic acid;dimethylphosphorylmethane;methane has a molecular weight of 202.17 g/mol, XLogP of 2.39, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethylphosphinic acid;dimethylphosphorylmethane;methane is sourced from PubChem (CID 161015324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).