Vinyloxyborane

C2H3BO — CID 22495045

IUPAC—
SMILES[B]OC=C
InChIInChI=1S/C2H3BO/c1-2-4-3/h2H,1H2
InChIKeyQZZSLKXZIUIQCB-UHFFFAOYSA-N
MW53.86 g/mol
LogP0.23
Rot. Bonds1

About Vinyloxyborane

Vinyloxyborane (PubChem CID 22495045) has the molecular formula C2H3BO and a molecular weight of 53.86 g/mol.

Molecular Properties

Compound NameVinyloxyborane
PubChem CID22495045
Molecular FormulaC2H3BO
Molecular Weight53.86 g/mol
Exact Mass54.03
IUPAC Name—
SMILES[B]OC=C
InChIInChI=1S/C2H3BO/c1-2-4-3/h2H,1H2
InChIKeyQZZSLKXZIUIQCB-UHFFFAOYSA-N
XLogP0.23
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50053.86
LogP ≤ 50.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze Vinyloxyborane 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 Vinyloxyborane?
The IUPAC name of Vinyloxyborane (CID 22495045) is not available.
What is the SMILES notation for Vinyloxyborane?
The canonical SMILES for Vinyloxyborane is [B]OC=C.
What is the InChIKey of Vinyloxyborane?
The InChIKey is QZZSLKXZIUIQCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3BO/c1-2-4-3/h2H,1H2.
What are the key properties of Vinyloxyborane?
Vinyloxyborane has a molecular weight of 53.86 g/mol, XLogP of 0.23, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Vinyloxyborane is sourced from PubChem (CID 22495045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).