tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane

C14H32OSi — CID 91697323

IUPACtert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane
SMILESCCCC(C)C(CC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H32OSi/c1-9-11-12(3)13(10-2)15-16(7,8)14(4,5)6/h12-13H,9-11H2,1-8H3
InChIKeyBDRKWPUEYIRSFN-UHFFFAOYSA-N
MW244.49 g/mol
LogP5.22
Rot. Bonds6

About tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane

tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane (PubChem CID 91697323) has the molecular formula C14H32OSi and a molecular weight of 244.49 g/mol. Its IUPAC name is tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane
PubChem CID91697323
Molecular FormulaC14H32OSi
Molecular Weight244.49 g/mol
Exact Mass244.22
IUPAC Nametert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane
SMILESCCCC(C)C(CC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H32OSi/c1-9-11-12(3)13(10-2)15-16(7,8)14(4,5)6/h12-13H,9-11H2,1-8H3
InChIKeyBDRKWPUEYIRSFN-UHFFFAOYSA-N
XLogP5.22
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500244.49
LogP ≤ 55.22
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

Silane, [(2-ethylhexyl)oxy]trimethyl-
CID 554452
Ethyl 5-(sec-butylsulfanyl)-3-(4-chlorophenyl)-4-cyano-2-thiophenecarboxylate
CID 529215
Cyclohexanol, 2-methyl, DMTBS
CID 529214
Silane, dimethyl(3-heptyloxy)isohexyloxy-
CID 91698390
Silane, diethylisohexyloxy(4-methylpent-2-yloxy)-
CID 91698408
Silane, diethylisohexyloxy(2-octyloxy)-
CID 91698413
Silane, diethylisohexyloxy(4-octyloxy)-
CID 91698414
Silane, methylvinyl(2-ethylhexyloxy)isopropoxy-
CID 91699095
Silane, diethyl(6-ethyloct-3-yloxy)propoxy-
CID 91714695
Silane, diethylpropoxy(trans-4-methylcyclohexyloxy)-
CID 91714755
Silane, diethylbutoxy(3-methylpent-2-yloxy)-
CID 91719407
Silane, diethyl(6-ethyloct-3-yloxy)pentyloxy-
CID 91723826

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane?
The IUPAC name of tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane (CID 91697323) is tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane is CCCC(C)C(CC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane?
The InChIKey is BDRKWPUEYIRSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32OSi/c1-9-11-12(3)13(10-2)15-16(7,8)14(4,5)6/h12-13H,9-11H2,1-8H3.
What are the key properties of tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane?
tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane has a molecular weight of 244.49 g/mol, XLogP of 5.22, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(4-methylheptan-3-yloxy)silane is sourced from PubChem (CID 91697323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).