ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane

C5H11O6P2-3 — CID 158727156

IUPACethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane
SMILESC.C=CP(=O)([O-])O.C=CP(=O)([O-])[O-]
InChIInChI=1S/2C2H5O3P.CH4/c2*1-2-6(3,4)5;/h2*2H,1H2,(H2,3,4,5);1H4/p-3
InChIKeyIKQMYJGCIBFCJJ-UHFFFAOYSA-K
MW229.08 g/mol
LogP-0.64
Rot. Bonds2

About ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane

ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane (PubChem CID 158727156) has the molecular formula C5H11O6P2-3 and a molecular weight of 229.08 g/mol. Its IUPAC name is ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane.

Molecular Properties

Compound Nameethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane
PubChem CID158727156
Molecular FormulaC5H11O6P2-3
Molecular Weight229.08 g/mol
Exact Mass229.00
IUPAC Nameethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane
SMILESC.C=CP(=O)([O-])O.C=CP(=O)([O-])[O-]
InChIInChI=1S/2C2H5O3P.CH4/c2*1-2-6(3,4)5;/h2*2H,1H2,(H2,3,4,5);1H4/p-3
InChIKeyIKQMYJGCIBFCJJ-UHFFFAOYSA-K
XLogP-0.64
TPSA123.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.08
LogP ≤ 5-0.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

lithium ethenyl(methyl)phosphinate
CID 162165650
tetralithium;ethenyl-dioxido-oxo-λ5-phosphane;2-methylprop-2-enoate;prop-2-enoate
CID 142698046
[ethenyl(hydroxy)phosphoryl]methylphosphonic acid
CID 21059595
hafnium;hydrogen phosphate
CID 160536753
bis(chromium(3+));hydrogen phosphate
CID 19708255
tetrakis(dihydrogen phosphate);zirconium(4+)
CID 22328152
tetrakis(dihydrogen phosphate);tetrakis(thallium(1+))
CID 139063709
zinc bis(dihydrogen phosphate)
CID 11253952
dizinc;tetrakis(dihydrogen phosphate)
CID 161370337
hydrogen phosphate;bis(lutetium(3+))
CID 159566068
hexakis(dihydrogen phosphate);molybdenum
CID 18504359
sodium dihydroxy(32P)phosphinate
CID 23694678

Frequently Asked Questions

What is the IUPAC name of ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane?
The IUPAC name of ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane (CID 158727156) is ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane.
What is the SMILES notation for ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane?
The canonical SMILES for ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane is C.C=CP(=O)([O-])O.C=CP(=O)([O-])[O-].
What is the InChIKey of ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane?
The InChIKey is IKQMYJGCIBFCJJ-UHFFFAOYSA-K. The full InChI is InChI=1S/2C2H5O3P.CH4/c2*1-2-6(3,4)5;/h2*2H,1H2,(H2,3,4,5);1H4/p-3.
What are the key properties of ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane?
ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane has a molecular weight of 229.08 g/mol, XLogP of -0.64, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-dioxido-oxo-λ5-phosphane;ethenyl(hydroxy)phosphinate;methane is sourced from PubChem (CID 158727156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).