(2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane

C11H22OSi — CID 173435633

IUPAC(2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane
SMILESCC1=C(O[SiH3])CCC(C)(C)C1(C)C
InChIInChI=1S/C11H22OSi/c1-8-9(12-13)6-7-10(2,3)11(8,4)5/h6-7H2,1-5,13H3
InChIKeyVDLJQISLHWWKLX-UHFFFAOYSA-N
MW198.38 g/mol
LogP2.40
Rot. Bonds1

About (2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane

(2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane (PubChem CID 173435633) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is (2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane.

Molecular Properties

Compound Name(2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane
PubChem CID173435633
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name(2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane
SMILESCC1=C(O[SiH3])CCC(C)(C)C1(C)C
InChIInChI=1S/C11H22OSi/c1-8-9(12-13)6-7-10(2,3)11(8,4)5/h6-7H2,1-5,13H3
InChIKeyVDLJQISLHWWKLX-UHFFFAOYSA-N
XLogP2.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 22177376
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CID 88119043
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CID 91003484
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CID 153512958
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CID 153512959
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CID 153512960
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CID 153512961
CID 153512961

Frequently Asked Questions

What is the IUPAC name of (2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane?
The IUPAC name of (2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane (CID 173435633) is (2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane.
What is the SMILES notation for (2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane?
The canonical SMILES for (2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane is CC1=C(O[SiH3])CCC(C)(C)C1(C)C.
What is the InChIKey of (2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane?
The InChIKey is VDLJQISLHWWKLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22OSi/c1-8-9(12-13)6-7-10(2,3)11(8,4)5/h6-7H2,1-5,13H3.
What are the key properties of (2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane?
(2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane has a molecular weight of 198.38 g/mol, XLogP of 2.40, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3,3,4,4-pentamethylcyclohexen-1-yl)oxysilane is sourced from PubChem (CID 173435633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).