trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane

C17H28OSi — CID 103438651

IUPACtrimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane
SMILESCC1CCCC(OCc2ccc([Si](C)(C)C)cc2)C1
InChIInChI=1S/C17H28OSi/c1-14-6-5-7-16(12-14)18-13-15-8-10-17(11-9-15)19(2,3)4/h8-11,14,16H,5-7,12-13H2,1-4H3
InChIKeyQATXKCURXIFBCZ-UHFFFAOYSA-N
MW276.50 g/mol
LogP4.33
Rot. Bonds4

About trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane

trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane (PubChem CID 103438651) has the molecular formula C17H28OSi and a molecular weight of 276.50 g/mol. Its IUPAC name is trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane.

Molecular Properties

Compound Nametrimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane
PubChem CID103438651
Molecular FormulaC17H28OSi
Molecular Weight276.50 g/mol
Exact Mass276.19
IUPAC Nametrimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane
SMILESCC1CCCC(OCc2ccc([Si](C)(C)C)cc2)C1
InChIInChI=1S/C17H28OSi/c1-14-6-5-7-16(12-14)18-13-15-8-10-17(11-9-15)19(2,3)4/h8-11,14,16H,5-7,12-13H2,1-4H3
InChIKeyQATXKCURXIFBCZ-UHFFFAOYSA-N
XLogP4.33
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.50
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane?
The IUPAC name of trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane (CID 103438651) is trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane.
What is the SMILES notation for trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane?
The canonical SMILES for trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane is CC1CCCC(OCc2ccc([Si](C)(C)C)cc2)C1.
What is the InChIKey of trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane?
The InChIKey is QATXKCURXIFBCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28OSi/c1-14-6-5-7-16(12-14)18-13-15-8-10-17(11-9-15)19(2,3)4/h8-11,14,16H,5-7,12-13H2,1-4H3.
What are the key properties of trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane?
trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane has a molecular weight of 276.50 g/mol, XLogP of 4.33, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-[(3-methylcyclohexyl)oxymethyl]phenyl]silane is sourced from PubChem (CID 103438651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).