methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid

C4H8NO5P — CID 70480540

IUPACmethyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid
SMILESCP(=O)(O)ON1CCOC1=O
InChIInChI=1S/C4H8NO5P/c1-11(7,8)10-5-2-3-9-4(5)6/h2-3H2,1H3,(H,7,8)
InChIKeyFEJUAQNBDBNGRR-UHFFFAOYSA-N
MW181.08 g/mol
LogP0.19
Rot. Bonds2

About methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid

methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid (PubChem CID 70480540) has the molecular formula C4H8NO5P and a molecular weight of 181.08 g/mol. Its IUPAC name is methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid.

Molecular Properties

Compound Namemethyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid
PubChem CID70480540
Molecular FormulaC4H8NO5P
Molecular Weight181.08 g/mol
Exact Mass181.01
IUPAC Namemethyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid
SMILESCP(=O)(O)ON1CCOC1=O
InChIInChI=1S/C4H8NO5P/c1-11(7,8)10-5-2-3-9-4(5)6/h2-3H2,1H3,(H,7,8)
InChIKeyFEJUAQNBDBNGRR-UHFFFAOYSA-N
XLogP0.19
TPSA76.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.08
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid?
The IUPAC name of methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid (CID 70480540) is methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid.
What is the SMILES notation for methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid?
The canonical SMILES for methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid is CP(=O)(O)ON1CCOC1=O.
What is the InChIKey of methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid?
The InChIKey is FEJUAQNBDBNGRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8NO5P/c1-11(7,8)10-5-2-3-9-4(5)6/h2-3H2,1H3,(H,7,8).
What are the key properties of methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid?
methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid has a molecular weight of 181.08 g/mol, XLogP of 0.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphinic acid is sourced from PubChem (CID 70480540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).