hexan-3-yl-tri(propan-2-yloxy)silane

C15H34O3Si — CID 141028246

IUPAChexan-3-yl-tri(propan-2-yloxy)silane
SMILESCCCC(CC)[Si](OC(C)C)(OC(C)C)OC(C)C
InChIInChI=1S/C15H34O3Si/c1-9-11-15(10-2)19(16-12(3)4,17-13(5)6)18-14(7)8/h12-15H,9-11H2,1-8H3
InChIKeyMTGVZVVHPZIFFO-UHFFFAOYSA-N
MW290.52 g/mol
LogP4.78
Rot. Bonds10

About hexan-3-yl-tri(propan-2-yloxy)silane

hexan-3-yl-tri(propan-2-yloxy)silane (PubChem CID 141028246) has the molecular formula C15H34O3Si and a molecular weight of 290.52 g/mol. Its IUPAC name is hexan-3-yl-tri(propan-2-yloxy)silane.

Molecular Properties

Compound Namehexan-3-yl-tri(propan-2-yloxy)silane
PubChem CID141028246
Molecular FormulaC15H34O3Si
Molecular Weight290.52 g/mol
Exact Mass290.23
IUPAC Namehexan-3-yl-tri(propan-2-yloxy)silane
SMILESCCCC(CC)[Si](OC(C)C)(OC(C)C)OC(C)C
InChIInChI=1S/C15H34O3Si/c1-9-11-15(10-2)19(16-12(3)4,17-13(5)6)18-14(7)8/h12-15H,9-11H2,1-8H3
InChIKeyMTGVZVVHPZIFFO-UHFFFAOYSA-N
XLogP4.78
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.52
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 hexan-3-yl-tri(propan-2-yloxy)silane?
The IUPAC name of hexan-3-yl-tri(propan-2-yloxy)silane (CID 141028246) is hexan-3-yl-tri(propan-2-yloxy)silane.
What is the SMILES notation for hexan-3-yl-tri(propan-2-yloxy)silane?
The canonical SMILES for hexan-3-yl-tri(propan-2-yloxy)silane is CCCC(CC)[Si](OC(C)C)(OC(C)C)OC(C)C.
What is the InChIKey of hexan-3-yl-tri(propan-2-yloxy)silane?
The InChIKey is MTGVZVVHPZIFFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34O3Si/c1-9-11-15(10-2)19(16-12(3)4,17-13(5)6)18-14(7)8/h12-15H,9-11H2,1-8H3.
What are the key properties of hexan-3-yl-tri(propan-2-yloxy)silane?
hexan-3-yl-tri(propan-2-yloxy)silane has a molecular weight of 290.52 g/mol, XLogP of 4.78, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hexan-3-yl-tri(propan-2-yloxy)silane is sourced from PubChem (CID 141028246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).