di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane

C20H46OSi2 — CID 90312723

IUPACdi(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane
SMILESCCC(C)[Si](CC)(O[Si](CC)(C(C)CC)C(C)CC)C(C)CC
InChIInChI=1S/C20H46OSi2/c1-11-17(7)22(15-5,18(8)12-2)21-23(16-6,19(9)13-3)20(10)14-4/h17-20H,11-16H2,1-10H3
InChIKeyKLHMYIMRKIGBQL-UHFFFAOYSA-N
MW358.76 g/mol
LogP8.13
Rot. Bonds12

About di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane

di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane (PubChem CID 90312723) has the molecular formula C20H46OSi2 and a molecular weight of 358.76 g/mol. Its IUPAC name is di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane.

Molecular Properties

Compound Namedi(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane
PubChem CID90312723
Molecular FormulaC20H46OSi2
Molecular Weight358.76 g/mol
Exact Mass358.31
IUPAC Namedi(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane
SMILESCCC(C)[Si](CC)(O[Si](CC)(C(C)CC)C(C)CC)C(C)CC
InChIInChI=1S/C20H46OSi2/c1-11-17(7)22(15-5,18(8)12-2)21-23(16-6,19(9)13-3)20(10)14-4/h17-20H,11-16H2,1-10H3
InChIKeyKLHMYIMRKIGBQL-UHFFFAOYSA-N
XLogP8.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.76
LogP ≤ 58.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane 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 di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane?
The IUPAC name of di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane (CID 90312723) is di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane.
What is the SMILES notation for di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane?
The canonical SMILES for di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane is CCC(C)[Si](CC)(O[Si](CC)(C(C)CC)C(C)CC)C(C)CC.
What is the InChIKey of di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane?
The InChIKey is KLHMYIMRKIGBQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H46OSi2/c1-11-17(7)22(15-5,18(8)12-2)21-23(16-6,19(9)13-3)20(10)14-4/h17-20H,11-16H2,1-10H3.
What are the key properties of di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane?
di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane has a molecular weight of 358.76 g/mol, XLogP of 8.13, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for di(butan-2-yl)-[di(butan-2-yl)-ethylsilyl]oxy-ethylsilane is sourced from PubChem (CID 90312723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).