bis(3-tert-butylcyclopentyl)-dimethoxysilane

C20H40O2Si — CID 18318744

IUPACbis(3-tert-butylcyclopentyl)-dimethoxysilane
SMILESCO[Si](OC)(C1CCC(C(C)(C)C)C1)C1CCC(C(C)(C)C)C1
InChIInChI=1S/C20H40O2Si/c1-19(2,3)15-9-11-17(13-15)23(21-7,22-8)18-12-10-16(14-18)20(4,5)6/h15-18H,9-14H2,1-8H3
InChIKeyYKCNYZDXCPLTBK-UHFFFAOYSA-N
MW340.62 g/mol
LogP6.15
Rot. Bonds4

About bis(3-tert-butylcyclopentyl)-dimethoxysilane

bis(3-tert-butylcyclopentyl)-dimethoxysilane (PubChem CID 18318744) has the molecular formula C20H40O2Si and a molecular weight of 340.62 g/mol. Its IUPAC name is bis(3-tert-butylcyclopentyl)-dimethoxysilane.

Molecular Properties

Compound Namebis(3-tert-butylcyclopentyl)-dimethoxysilane
PubChem CID18318744
Molecular FormulaC20H40O2Si
Molecular Weight340.62 g/mol
Exact Mass340.28
IUPAC Namebis(3-tert-butylcyclopentyl)-dimethoxysilane
SMILESCO[Si](OC)(C1CCC(C(C)(C)C)C1)C1CCC(C(C)(C)C)C1
InChIInChI=1S/C20H40O2Si/c1-19(2,3)15-9-11-17(13-15)23(21-7,22-8)18-12-10-16(14-18)20(4,5)6/h15-18H,9-14H2,1-8H3
InChIKeyYKCNYZDXCPLTBK-UHFFFAOYSA-N
XLogP6.15
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500340.62
LogP ≤ 56.15
H-Bond Donors ≤ 50
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(3-tert-butylcyclopentyl)-dimethoxysilane?
The IUPAC name of bis(3-tert-butylcyclopentyl)-dimethoxysilane (CID 18318744) is bis(3-tert-butylcyclopentyl)-dimethoxysilane.
What is the SMILES notation for bis(3-tert-butylcyclopentyl)-dimethoxysilane?
The canonical SMILES for bis(3-tert-butylcyclopentyl)-dimethoxysilane is CO[Si](OC)(C1CCC(C(C)(C)C)C1)C1CCC(C(C)(C)C)C1.
What is the InChIKey of bis(3-tert-butylcyclopentyl)-dimethoxysilane?
The InChIKey is YKCNYZDXCPLTBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40O2Si/c1-19(2,3)15-9-11-17(13-15)23(21-7,22-8)18-12-10-16(14-18)20(4,5)6/h15-18H,9-14H2,1-8H3.
What are the key properties of bis(3-tert-butylcyclopentyl)-dimethoxysilane?
bis(3-tert-butylcyclopentyl)-dimethoxysilane has a molecular weight of 340.62 g/mol, XLogP of 6.15, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3-tert-butylcyclopentyl)-dimethoxysilane is sourced from PubChem (CID 18318744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).