(2E)-2-hydroxyiminoacetyl iodide

C2H2INO2 — CID 88576223

IUPAC(2E)-2-hydroxyiminoacetyl iodide
SMILESO=C(I)/C=N/O
InChIInChI=1S/C2H2INO2/c3-2(5)1-4-6/h1,6H/b4-1+
InChIKeyFWRQWPDSRIPRKB-DAFODLJHSA-N
MW198.95 g/mol
LogP0.41
Rot. Bonds1

About (2E)-2-hydroxyiminoacetyl iodide

(2E)-2-hydroxyiminoacetyl iodide (PubChem CID 88576223) has the molecular formula C2H2INO2 and a molecular weight of 198.95 g/mol. Its IUPAC name is (2E)-2-hydroxyiminoacetyl iodide.

Molecular Properties

Compound Name(2E)-2-hydroxyiminoacetyl iodide
PubChem CID88576223
Molecular FormulaC2H2INO2
Molecular Weight198.95 g/mol
Exact Mass198.91
IUPAC Name(2E)-2-hydroxyiminoacetyl iodide
SMILESO=C(I)/C=N/O
InChIInChI=1S/C2H2INO2/c3-2(5)1-4-6/h1,6H/b4-1+
InChIKeyFWRQWPDSRIPRKB-DAFODLJHSA-N
XLogP0.41
TPSA49.66 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.95
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2E)-2-hydroxyiminoacetyl iodide?
The IUPAC name of (2E)-2-hydroxyiminoacetyl iodide (CID 88576223) is (2E)-2-hydroxyiminoacetyl iodide.
What is the SMILES notation for (2E)-2-hydroxyiminoacetyl iodide?
The canonical SMILES for (2E)-2-hydroxyiminoacetyl iodide is O=C(I)/C=N/O.
What is the InChIKey of (2E)-2-hydroxyiminoacetyl iodide?
The InChIKey is FWRQWPDSRIPRKB-DAFODLJHSA-N. The full InChI is InChI=1S/C2H2INO2/c3-2(5)1-4-6/h1,6H/b4-1+.
What are the key properties of (2E)-2-hydroxyiminoacetyl iodide?
(2E)-2-hydroxyiminoacetyl iodide has a molecular weight of 198.95 g/mol, XLogP of 0.41, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-hydroxyiminoacetyl iodide is sourced from PubChem (CID 88576223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).