methoxy-(2-methoxy-2-oxoethyl)phosphinic acid

C4H9O5P — CID 15715183

IUPACmethoxy-(2-methoxy-2-oxoethyl)phosphinic acid
SMILESCOC(=O)CP(=O)(O)OC
InChIInChI=1S/C4H9O5P/c1-8-4(5)3-10(6,7)9-2/h3H2,1-2H3,(H,6,7)
InChIKeyZQXZJOLWLKVYIM-UHFFFAOYSA-N
MW168.08 g/mol
LogP-0.01
Rot. Bonds3

About methoxy-(2-methoxy-2-oxoethyl)phosphinic acid

methoxy-(2-methoxy-2-oxoethyl)phosphinic acid (PubChem CID 15715183) has the molecular formula C4H9O5P and a molecular weight of 168.08 g/mol. Its IUPAC name is methoxy-(2-methoxy-2-oxoethyl)phosphinic acid.

Molecular Properties

Compound Namemethoxy-(2-methoxy-2-oxoethyl)phosphinic acid
PubChem CID15715183
Molecular FormulaC4H9O5P
Molecular Weight168.08 g/mol
Exact Mass168.02
IUPAC Namemethoxy-(2-methoxy-2-oxoethyl)phosphinic acid
SMILESCOC(=O)CP(=O)(O)OC
InChIInChI=1S/C4H9O5P/c1-8-4(5)3-10(6,7)9-2/h3H2,1-2H3,(H,6,7)
InChIKeyZQXZJOLWLKVYIM-UHFFFAOYSA-N
XLogP-0.01
TPSA72.83 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.08
LogP ≤ 5-0.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

ethoxy-(2-methoxy-2-oxoethyl)phosphinic acid
CID 86208858
methoxy(methoxymethyl)phosphinic acid
CID 54547216
methyl 2-[methoxy(prop-1-ynyl)phosphoryl]acetate
CID 14111840
methyl 2-[butoxy-(2-methoxy-2-oxoethyl)phosphoryl]acetate
CID 2304620
methoxy-(5-methoxy-2-methoxycarbonyl-5-oxopentyl)phosphinic acid
CID 89208279
[hydroxy(methoxy)phosphoryl]methyl-methylphosphinic acid
CID 20709857
(7-methoxy-2,7-dioxoheptyl)phosphonic acid
CID 21497644
CID 87726616
CID 87726616
decyl(methoxy)phosphinic acid
CID 54568982
methoxy(2-methylpropyl)phosphinic acid
CID 54548928
methoxy-[3-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propyl]phosphinic acid
CID 161196889
ethoxy-(2-ethoxy-2-oxoethyl)phosphinic acid
CID 3613986

Frequently Asked Questions

What is the IUPAC name of methoxy-(2-methoxy-2-oxoethyl)phosphinic acid?
The IUPAC name of methoxy-(2-methoxy-2-oxoethyl)phosphinic acid (CID 15715183) is methoxy-(2-methoxy-2-oxoethyl)phosphinic acid.
What is the SMILES notation for methoxy-(2-methoxy-2-oxoethyl)phosphinic acid?
The canonical SMILES for methoxy-(2-methoxy-2-oxoethyl)phosphinic acid is COC(=O)CP(=O)(O)OC.
What is the InChIKey of methoxy-(2-methoxy-2-oxoethyl)phosphinic acid?
The InChIKey is ZQXZJOLWLKVYIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9O5P/c1-8-4(5)3-10(6,7)9-2/h3H2,1-2H3,(H,6,7).
What are the key properties of methoxy-(2-methoxy-2-oxoethyl)phosphinic acid?
methoxy-(2-methoxy-2-oxoethyl)phosphinic acid has a molecular weight of 168.08 g/mol, XLogP of -0.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-(2-methoxy-2-oxoethyl)phosphinic acid is sourced from PubChem (CID 15715183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).