bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane

C24H52O4Si — CID 175828140

IUPACbis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane
SMILESCCOC(CC)CC(CC)[Si](OC(C)C)(OC(C)C)C(CC)CC(CC)OCC
InChIInChI=1S/C24H52O4Si/c1-11-21(25-15-5)17-23(13-3)29(27-19(7)8,28-20(9)10)24(14-4)18-22(12-2)26-16-6/h19-24H,11-18H2,1-10H3
InChIKeySQRHVRDSRRLVST-UHFFFAOYSA-N
MW432.76 g/mol
LogP7.25
Rot. Bonds18

About bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane

bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane (PubChem CID 175828140) has the molecular formula C24H52O4Si and a molecular weight of 432.76 g/mol. Its IUPAC name is bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane.

Molecular Properties

Compound Namebis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane
PubChem CID175828140
Molecular FormulaC24H52O4Si
Molecular Weight432.76 g/mol
Exact Mass432.36
IUPAC Namebis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane
SMILESCCOC(CC)CC(CC)[Si](OC(C)C)(OC(C)C)C(CC)CC(CC)OCC
InChIInChI=1S/C24H52O4Si/c1-11-21(25-15-5)17-23(13-3)29(27-19(7)8,28-20(9)10)24(14-4)18-22(12-2)26-16-6/h19-24H,11-18H2,1-10H3
InChIKeySQRHVRDSRRLVST-UHFFFAOYSA-N
XLogP7.25
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds18
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.76
LogP ≤ 57.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)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 bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane?
The IUPAC name of bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane (CID 175828140) is bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane.
What is the SMILES notation for bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane?
The canonical SMILES for bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane is CCOC(CC)CC(CC)[Si](OC(C)C)(OC(C)C)C(CC)CC(CC)OCC.
What is the InChIKey of bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane?
The InChIKey is SQRHVRDSRRLVST-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52O4Si/c1-11-21(25-15-5)17-23(13-3)29(27-19(7)8,28-20(9)10)24(14-4)18-22(12-2)26-16-6/h19-24H,11-18H2,1-10H3.
What are the key properties of bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane?
bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane has a molecular weight of 432.76 g/mol, XLogP of 7.25, 18 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(5-ethoxyheptan-3-yl)-di(propan-2-yloxy)silane is sourced from PubChem (CID 175828140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).