cyclohexyl-tri(pentan-3-yl)silane

C21H44Si — CID 139968935

IUPACcyclohexyl-tri(pentan-3-yl)silane
SMILESCCC(CC)[Si](C(CC)CC)(C(CC)CC)C1CCCCC1
InChIInChI=1S/C21H44Si/c1-7-18(8-2)22(19(9-3)10-4,20(11-5)12-6)21-16-14-13-15-17-21/h18-21H,7-17H2,1-6H3
InChIKeyCZWZTLFMGPQMBC-UHFFFAOYSA-N
MW324.67 g/mol
LogP8.34
Rot. Bonds10

About cyclohexyl-tri(pentan-3-yl)silane

cyclohexyl-tri(pentan-3-yl)silane (PubChem CID 139968935) has the molecular formula C21H44Si and a molecular weight of 324.67 g/mol. Its IUPAC name is cyclohexyl-tri(pentan-3-yl)silane.

Molecular Properties

Compound Namecyclohexyl-tri(pentan-3-yl)silane
PubChem CID139968935
Molecular FormulaC21H44Si
Molecular Weight324.67 g/mol
Exact Mass324.32
IUPAC Namecyclohexyl-tri(pentan-3-yl)silane
SMILESCCC(CC)[Si](C(CC)CC)(C(CC)CC)C1CCCCC1
InChIInChI=1S/C21H44Si/c1-7-18(8-2)22(19(9-3)10-4,20(11-5)12-6)21-16-14-13-15-17-21/h18-21H,7-17H2,1-6H3
InChIKeyCZWZTLFMGPQMBC-UHFFFAOYSA-N
XLogP8.34
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.67
LogP ≤ 58.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 cyclohexyl-tri(pentan-3-yl)silane?
The IUPAC name of cyclohexyl-tri(pentan-3-yl)silane (CID 139968935) is cyclohexyl-tri(pentan-3-yl)silane.
What is the SMILES notation for cyclohexyl-tri(pentan-3-yl)silane?
The canonical SMILES for cyclohexyl-tri(pentan-3-yl)silane is CCC(CC)[Si](C(CC)CC)(C(CC)CC)C1CCCCC1.
What is the InChIKey of cyclohexyl-tri(pentan-3-yl)silane?
The InChIKey is CZWZTLFMGPQMBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H44Si/c1-7-18(8-2)22(19(9-3)10-4,20(11-5)12-6)21-16-14-13-15-17-21/h18-21H,7-17H2,1-6H3.
What are the key properties of cyclohexyl-tri(pentan-3-yl)silane?
cyclohexyl-tri(pentan-3-yl)silane has a molecular weight of 324.67 g/mol, XLogP of 8.34, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-tri(pentan-3-yl)silane is sourced from PubChem (CID 139968935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).