tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane

C17H34OSi — CID 22177368

IUPACtert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1C/C=C\CCCCCCC1
InChIInChI=1S/C17H34OSi/c1-17(2,3)19(4,5)18-16-14-12-10-8-6-7-9-11-13-15-16/h10,12,16H,6-9,11,13-15H2,1-5H3/b12-10-
InChIKeyJSGKHTYHWKZCIQ-BENRWUELSA-N
MW282.54 g/mol
LogP6.07
Rot. Bonds2

About tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane

tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane (PubChem CID 22177368) has the molecular formula C17H34OSi and a molecular weight of 282.54 g/mol. Its IUPAC name is tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane
PubChem CID22177368
Molecular FormulaC17H34OSi
Molecular Weight282.54 g/mol
Exact Mass282.24
IUPAC Nametert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OC1C/C=C\CCCCCCC1
InChIInChI=1S/C17H34OSi/c1-17(2,3)19(4,5)18-16-14-12-10-8-6-7-9-11-13-15-16/h10,12,16H,6-9,11,13-15H2,1-5H3/b12-10-
InChIKeyJSGKHTYHWKZCIQ-BENRWUELSA-N
XLogP6.07
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.54
LogP ≤ 56.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane (CID 22177368) is tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane is CC(C)(C)[Si](C)(C)OC1C/C=C\CCCCCCC1.
What is the InChIKey of tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane?
The InChIKey is JSGKHTYHWKZCIQ-BENRWUELSA-N. The full InChI is InChI=1S/C17H34OSi/c1-17(2,3)19(4,5)18-16-14-12-10-8-6-7-9-11-13-15-16/h10,12,16H,6-9,11,13-15H2,1-5H3/b12-10-.
What are the key properties of tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane?
tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane has a molecular weight of 282.54 g/mol, XLogP of 6.07, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(3Z)-cycloundec-3-en-1-yl]oxy-dimethylsilane is sourced from PubChem (CID 22177368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).