methyl (2Z)-2-hydroxyiminoacetate

C3H5NO3 — CID 6399851

IUPACmethyl (2Z)-2-hydroxyiminoacetate
SMILESCOC(=O)/C=N\O
InChIInChI=1S/C3H5NO3/c1-7-3(5)2-4-6/h2,6H,1H3/b4-2-
InChIKeyFOOPJRSDKYBEGG-RQOWECAXSA-N
MW103.08 g/mol
LogP-0.38
Rot. Bonds1

About methyl (2Z)-2-hydroxyiminoacetate

methyl (2Z)-2-hydroxyiminoacetate (PubChem CID 6399851) has the molecular formula C3H5NO3 and a molecular weight of 103.08 g/mol. Its IUPAC name is methyl (2Z)-2-hydroxyiminoacetate.

Molecular Properties

Compound Namemethyl (2Z)-2-hydroxyiminoacetate
PubChem CID6399851
Molecular FormulaC3H5NO3
Molecular Weight103.08 g/mol
Exact Mass103.03
IUPAC Namemethyl (2Z)-2-hydroxyiminoacetate
SMILESCOC(=O)/C=N\O
InChIInChI=1S/C3H5NO3/c1-7-3(5)2-4-6/h2,6H,1H3/b4-2-
InChIKeyFOOPJRSDKYBEGG-RQOWECAXSA-N
XLogP-0.38
TPSA58.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.08
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
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'}

Analyze methyl (2Z)-2-hydroxyiminoacetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methyl (2Z)-2-hydroxyiminoacetate?
The IUPAC name of methyl (2Z)-2-hydroxyiminoacetate (CID 6399851) is methyl (2Z)-2-hydroxyiminoacetate.
What is the SMILES notation for methyl (2Z)-2-hydroxyiminoacetate?
The canonical SMILES for methyl (2Z)-2-hydroxyiminoacetate is COC(=O)/C=N\O.
What is the InChIKey of methyl (2Z)-2-hydroxyiminoacetate?
The InChIKey is FOOPJRSDKYBEGG-RQOWECAXSA-N. The full InChI is InChI=1S/C3H5NO3/c1-7-3(5)2-4-6/h2,6H,1H3/b4-2-.
What are the key properties of methyl (2Z)-2-hydroxyiminoacetate?
methyl (2Z)-2-hydroxyiminoacetate has a molecular weight of 103.08 g/mol, XLogP of -0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl (2Z)-2-hydroxyiminoacetate is sourced from PubChem (CID 6399851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).