hydroxy-(2-methoxyiminoethoxy)-oxophosphanium

C3H7NO4P+ — CID 88631687

IUPAChydroxy-(2-methoxyiminoethoxy)-oxophosphanium
SMILESCON=CCO[P+](=O)O
InChIInChI=1S/C3H6NO4P/c1-7-4-2-3-8-9(5)6/h2H,3H2,1H3/p+1
InChIKeyXPFNIJWWIIOSEN-UHFFFAOYSA-O
MW152.07 g/mol
LogP0.28
Rot. Bonds4

About hydroxy-(2-methoxyiminoethoxy)-oxophosphanium

hydroxy-(2-methoxyiminoethoxy)-oxophosphanium (PubChem CID 88631687) has the molecular formula C3H7NO4P+ and a molecular weight of 152.07 g/mol. Its IUPAC name is hydroxy-(2-methoxyiminoethoxy)-oxophosphanium.

Molecular Properties

Compound Namehydroxy-(2-methoxyiminoethoxy)-oxophosphanium
PubChem CID88631687
Molecular FormulaC3H7NO4P+
Molecular Weight152.07 g/mol
Exact Mass152.01
IUPAC Namehydroxy-(2-methoxyiminoethoxy)-oxophosphanium
SMILESCON=CCO[P+](=O)O
InChIInChI=1S/C3H6NO4P/c1-7-4-2-3-8-9(5)6/h2H,3H2,1H3/p+1
InChIKeyXPFNIJWWIIOSEN-UHFFFAOYSA-O
XLogP0.28
TPSA68.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.07
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

(NE)-N-(2-diethoxyphosphorylethylidene)hydroxylamine
CID 13204159
Iminodimethylene phosphoric acid
CID 91329206
6h-1,3,4,2lambda5-Dioxazaphosphinin-2-one
CID 129877223
bis[(2E)-2-methoxyiminoethoxy]-oxophosphanium
CID 17769584
2-(Ethylideneamino)oxyethoxy-methylphosphinic acid
CID 59073323
Diethyl [2-(hydroxyimino)ethyl]phosphonate
CID 71335397
Bis(2-methoxyiminoethoxy)-oxophosphanium
CID 73410668
2-Methyliminoethyl dihydrogen phosphate
CID 88418481
N-methoxy-2-[methoxy(methyl)phosphoryl]oxyethanimine
CID 88631889
2-Diazoethyl methyl hydrogen phosphate
CID 140513857
(NE)-N-[2-[ethoxy(methoxy)phosphoryl]ethylidene]hydroxylamine
CID 146347071
2-Ethoxyiminoethoxy-methyl-oxophosphanium
CID 151695946

Frequently Asked Questions

What is the IUPAC name of hydroxy-(2-methoxyiminoethoxy)-oxophosphanium?
The IUPAC name of hydroxy-(2-methoxyiminoethoxy)-oxophosphanium (CID 88631687) is hydroxy-(2-methoxyiminoethoxy)-oxophosphanium.
What is the SMILES notation for hydroxy-(2-methoxyiminoethoxy)-oxophosphanium?
The canonical SMILES for hydroxy-(2-methoxyiminoethoxy)-oxophosphanium is CON=CCO[P+](=O)O.
What is the InChIKey of hydroxy-(2-methoxyiminoethoxy)-oxophosphanium?
The InChIKey is XPFNIJWWIIOSEN-UHFFFAOYSA-O. The full InChI is InChI=1S/C3H6NO4P/c1-7-4-2-3-8-9(5)6/h2H,3H2,1H3/p+1.
What are the key properties of hydroxy-(2-methoxyiminoethoxy)-oxophosphanium?
hydroxy-(2-methoxyiminoethoxy)-oxophosphanium has a molecular weight of 152.07 g/mol, XLogP of 0.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-(2-methoxyiminoethoxy)-oxophosphanium is sourced from PubChem (CID 88631687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).