cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane

C20H36O2Si — CID 174913626

IUPACcyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane
SMILESCC[Si](OC(C)C)(OC(C)(C)C1=CCCCC1)C1=CCCCC1
InChIInChI=1S/C20H36O2Si/c1-6-23(21-17(2)3,19-15-11-8-12-16-19)22-20(4,5)18-13-9-7-10-14-18/h13,15,17H,6-12,14,16H2,1-5H3
InChIKeyYHYGTXCQPMBPQL-UHFFFAOYSA-N
MW336.59 g/mol
LogP6.21
Rot. Bonds7

About cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane

cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane (PubChem CID 174913626) has the molecular formula C20H36O2Si and a molecular weight of 336.59 g/mol. Its IUPAC name is cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane.

Molecular Properties

Compound Namecyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane
PubChem CID174913626
Molecular FormulaC20H36O2Si
Molecular Weight336.59 g/mol
Exact Mass336.25
IUPAC Namecyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane
SMILESCC[Si](OC(C)C)(OC(C)(C)C1=CCCCC1)C1=CCCCC1
InChIInChI=1S/C20H36O2Si/c1-6-23(21-17(2)3,19-15-11-8-12-16-19)22-20(4,5)18-13-9-7-10-14-18/h13,15,17H,6-12,14,16H2,1-5H3
InChIKeyYHYGTXCQPMBPQL-UHFFFAOYSA-N
XLogP6.21
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.59
LogP ≤ 56.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane?
The IUPAC name of cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane (CID 174913626) is cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane.
What is the SMILES notation for cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane?
The canonical SMILES for cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane is CC[Si](OC(C)C)(OC(C)(C)C1=CCCCC1)C1=CCCCC1.
What is the InChIKey of cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane?
The InChIKey is YHYGTXCQPMBPQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H36O2Si/c1-6-23(21-17(2)3,19-15-11-8-12-16-19)22-20(4,5)18-13-9-7-10-14-18/h13,15,17H,6-12,14,16H2,1-5H3.
What are the key properties of cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane?
cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane has a molecular weight of 336.59 g/mol, XLogP of 6.21, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-yl-[2-(cyclohexen-1-yl)propan-2-yloxy]-ethyl-propan-2-yloxysilane is sourced from PubChem (CID 174913626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).