2-ethylbut-1-enyl(propoxy)silane

C9H20OSi — CID 154005459

IUPAC2-ethylbut-1-enyl(propoxy)silane
SMILESCCCO[SiH2]C=C(CC)CC
InChIInChI=1S/C9H20OSi/c1-4-7-10-11-8-9(5-2)6-3/h8H,4-7,11H2,1-3H3
InChIKeyANQJVPNQEXFVGG-UHFFFAOYSA-N
MW172.34 g/mol
LogP2.20
Rot. Bonds6

About 2-ethylbut-1-enyl(propoxy)silane

2-ethylbut-1-enyl(propoxy)silane (PubChem CID 154005459) has the molecular formula C9H20OSi and a molecular weight of 172.34 g/mol. Its IUPAC name is 2-ethylbut-1-enyl(propoxy)silane.

Molecular Properties

Compound Name2-ethylbut-1-enyl(propoxy)silane
PubChem CID154005459
Molecular FormulaC9H20OSi
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Name2-ethylbut-1-enyl(propoxy)silane
SMILESCCCO[SiH2]C=C(CC)CC
InChIInChI=1S/C9H20OSi/c1-4-7-10-11-8-9(5-2)6-3/h8H,4-7,11H2,1-3H3
InChIKeyANQJVPNQEXFVGG-UHFFFAOYSA-N
XLogP2.20
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.34
LogP ≤ 52.20
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'}

Analyze 2-ethylbut-1-enyl(propoxy)silane 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 2-ethylbut-1-enyl(propoxy)silane?
The IUPAC name of 2-ethylbut-1-enyl(propoxy)silane (CID 154005459) is 2-ethylbut-1-enyl(propoxy)silane.
What is the SMILES notation for 2-ethylbut-1-enyl(propoxy)silane?
The canonical SMILES for 2-ethylbut-1-enyl(propoxy)silane is CCCO[SiH2]C=C(CC)CC.
What is the InChIKey of 2-ethylbut-1-enyl(propoxy)silane?
The InChIKey is ANQJVPNQEXFVGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20OSi/c1-4-7-10-11-8-9(5-2)6-3/h8H,4-7,11H2,1-3H3.
What are the key properties of 2-ethylbut-1-enyl(propoxy)silane?
2-ethylbut-1-enyl(propoxy)silane has a molecular weight of 172.34 g/mol, XLogP of 2.20, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylbut-1-enyl(propoxy)silane is sourced from PubChem (CID 154005459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).