crotylmethoxysilane

C5H9OSi — CID 59955004

IUPAC—
SMILESCC=CCCO[Si]
InChIInChI=1S/C5H9OSi/c1-2-3-4-5-6-7/h2-3H,4-5H2,1H3
InChIKeyNJURBQOQJSIVFD-UHFFFAOYSA-N
MW113.21 g/mol
LogP1.05
Rot. Bonds3

About crotylmethoxysilane

crotylmethoxysilane (PubChem CID 59955004) has the molecular formula C5H9OSi and a molecular weight of 113.21 g/mol.

Molecular Properties

Compound Namecrotylmethoxysilane
PubChem CID59955004
Molecular FormulaC5H9OSi
Molecular Weight113.21 g/mol
Exact Mass113.04
IUPAC Name—
SMILESCC=CCCO[Si]
InChIInChI=1S/C5H9OSi/c1-2-3-4-5-6-7/h2-3H,4-5H2,1H3
InChIKeyNJURBQOQJSIVFD-UHFFFAOYSA-N
XLogP1.05
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.21
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze crotylmethoxysilane 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 crotylmethoxysilane?
The IUPAC name of crotylmethoxysilane (CID 59955004) is not available.
What is the SMILES notation for crotylmethoxysilane?
The canonical SMILES for crotylmethoxysilane is CC=CCCO[Si].
What is the InChIKey of crotylmethoxysilane?
The InChIKey is NJURBQOQJSIVFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9OSi/c1-2-3-4-5-6-7/h2-3H,4-5H2,1H3.
What are the key properties of crotylmethoxysilane?
crotylmethoxysilane has a molecular weight of 113.21 g/mol, XLogP of 1.05, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for crotylmethoxysilane is sourced from PubChem (CID 59955004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).