bis(2-ethylhexyl)-dihydroxysilane

C16H36O2Si — CID 19820859

IUPACbis(2-ethylhexyl)-dihydroxysilane
SMILESCCCCC(CC)C[Si](O)(O)CC(CC)CCCC
InChIInChI=1S/C16H36O2Si/c1-5-9-11-15(7-3)13-19(17,18)14-16(8-4)12-10-6-2/h15-18H,5-14H2,1-4H3
InChIKeyDVNIOQTVCSDOKL-UHFFFAOYSA-N
MW288.55 g/mol
LogP4.85
Rot. Bonds12

About bis(2-ethylhexyl)-dihydroxysilane

bis(2-ethylhexyl)-dihydroxysilane (PubChem CID 19820859) has the molecular formula C16H36O2Si and a molecular weight of 288.55 g/mol. Its IUPAC name is bis(2-ethylhexyl)-dihydroxysilane.

Molecular Properties

Compound Namebis(2-ethylhexyl)-dihydroxysilane
PubChem CID19820859
Molecular FormulaC16H36O2Si
Molecular Weight288.55 g/mol
Exact Mass288.25
IUPAC Namebis(2-ethylhexyl)-dihydroxysilane
SMILESCCCCC(CC)C[Si](O)(O)CC(CC)CCCC
InChIInChI=1S/C16H36O2Si/c1-5-9-11-15(7-3)13-19(17,18)14-16(8-4)12-10-6-2/h15-18H,5-14H2,1-4H3
InChIKeyDVNIOQTVCSDOKL-UHFFFAOYSA-N
XLogP4.85
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.55
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(2-ethylhexyl)-dihydroxysilane?
The IUPAC name of bis(2-ethylhexyl)-dihydroxysilane (CID 19820859) is bis(2-ethylhexyl)-dihydroxysilane.
What is the SMILES notation for bis(2-ethylhexyl)-dihydroxysilane?
The canonical SMILES for bis(2-ethylhexyl)-dihydroxysilane is CCCCC(CC)C[Si](O)(O)CC(CC)CCCC.
What is the InChIKey of bis(2-ethylhexyl)-dihydroxysilane?
The InChIKey is DVNIOQTVCSDOKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O2Si/c1-5-9-11-15(7-3)13-19(17,18)14-16(8-4)12-10-6-2/h15-18H,5-14H2,1-4H3.
What are the key properties of bis(2-ethylhexyl)-dihydroxysilane?
bis(2-ethylhexyl)-dihydroxysilane has a molecular weight of 288.55 g/mol, XLogP of 4.85, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-ethylhexyl)-dihydroxysilane is sourced from PubChem (CID 19820859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).