dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium

C4H9NO5P+ — CID 174430011

IUPACdihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium
SMILESC[P+](O)(O)ON1CCOC1=O
InChIInChI=1S/C4H9NO5P/c1-11(7,8)10-5-2-3-9-4(5)6/h7-8H,2-3H2,1H3/q+1
InChIKeyKKYDFACMOKJNOD-UHFFFAOYSA-N
MW182.09 g/mol
LogP-0.25
Rot. Bonds2

About dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium

dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium (PubChem CID 174430011) has the molecular formula C4H9NO5P+ and a molecular weight of 182.09 g/mol. Its IUPAC name is dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium.

Molecular Properties

Compound Namedihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium
PubChem CID174430011
Molecular FormulaC4H9NO5P+
Molecular Weight182.09 g/mol
Exact Mass182.02
IUPAC Namedihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium
SMILESC[P+](O)(O)ON1CCOC1=O
InChIInChI=1S/C4H9NO5P/c1-11(7,8)10-5-2-3-9-4(5)6/h7-8H,2-3H2,1H3/q+1
InChIKeyKKYDFACMOKJNOD-UHFFFAOYSA-N
XLogP-0.25
TPSA79.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.09
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium?
The IUPAC name of dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium (CID 174430011) is dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium.
What is the SMILES notation for dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium?
The canonical SMILES for dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium is C[P+](O)(O)ON1CCOC1=O.
What is the InChIKey of dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium?
The InChIKey is KKYDFACMOKJNOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO5P/c1-11(7,8)10-5-2-3-9-4(5)6/h7-8H,2-3H2,1H3/q+1.
What are the key properties of dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium?
dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium has a molecular weight of 182.09 g/mol, XLogP of -0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy-methyl-[(2-oxo-1,3-oxazolidin-3-yl)oxy]phosphanium is sourced from PubChem (CID 174430011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).