hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium

C2H5NO4P+ — CID 175557814

IUPAChydroxy-(2-hydroxyiminoethoxy)-oxophosphanium
SMILESO=[P+](O)OCC=NO
InChIInChI=1S/C2H4NO4P/c4-3-1-2-7-8(5)6/h1H,2H2,(H-,4,5,6)/p+1
InChIKeyFXXBVSBXJFJPPC-UHFFFAOYSA-O
MW138.04 g/mol
LogP0.11
Rot. Bonds3

About hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium

hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium (PubChem CID 175557814) has the molecular formula C2H5NO4P+ and a molecular weight of 138.04 g/mol. Its IUPAC name is hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium.

Molecular Properties

Compound Namehydroxy-(2-hydroxyiminoethoxy)-oxophosphanium
PubChem CID175557814
Molecular FormulaC2H5NO4P+
Molecular Weight138.04 g/mol
Exact Mass138.00
IUPAC Namehydroxy-(2-hydroxyiminoethoxy)-oxophosphanium
SMILESO=[P+](O)OCC=NO
InChIInChI=1S/C2H4NO4P/c4-3-1-2-7-8(5)6/h1H,2H2,(H-,4,5,6)/p+1
InChIKeyFXXBVSBXJFJPPC-UHFFFAOYSA-O
XLogP0.11
TPSA79.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.04
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_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

Iminodimethylene phosphoric acid
CID 91329206
6h-1,3,4,2lambda5-Dioxazaphosphinin-2-one
CID 129877223
[(2E)-1-hydroxy-2-hydroxyiminoethyl]phosphonic acid
CID 138970810
bis[(2E)-2-methoxyiminoethoxy]-oxophosphanium
CID 17769584
4,5-Dihydro-1,2-oxazole;dihydroxy(oxo)phosphanium
CID 21476066
Bis(2-methoxyiminoethoxy)-oxophosphanium
CID 73410668
Hydroxy-(2-iminoethoxy)-oxophosphanium
CID 87910469
Hydroxy-(2-methoxyiminoethoxy)-oxophosphanium
CID 88631687
N-methoxy-2-[methoxy(methyl)phosphoryl]oxyethanimine
CID 88631889
Bis(2-hydroxyiminoethoxy)-oxophosphanium
CID 175557821
Hydroxy-(3-hydroxyiminopropoxy)-oxophosphanium
CID 175557822
N-(2-phosphorosooxyethylidene)hydroxylamine
CID 175557827

Frequently Asked Questions

What is the IUPAC name of hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium?
The IUPAC name of hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium (CID 175557814) is hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium.
What is the SMILES notation for hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium?
The canonical SMILES for hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium is O=[P+](O)OCC=NO.
What is the InChIKey of hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium?
The InChIKey is FXXBVSBXJFJPPC-UHFFFAOYSA-O. The full InChI is InChI=1S/C2H4NO4P/c4-3-1-2-7-8(5)6/h1H,2H2,(H-,4,5,6)/p+1.
What are the key properties of hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium?
hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium has a molecular weight of 138.04 g/mol, XLogP of 0.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-(2-hydroxyiminoethoxy)-oxophosphanium is sourced from PubChem (CID 175557814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).