dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane

C15H34O3SSi — CID 173419270

IUPACdimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane
SMILESC[SiH](C)OC(OC(CC(C)(C)C)CC(C)(C)C)S(C)=O
InChIInChI=1S/C15H34O3SSi/c1-14(2,3)10-12(11-15(4,5)6)17-13(19(7)16)18-20(8)9/h12-13,20H,10-11H2,1-9H3
InChIKeyINRKCIGBVNARCQ-UHFFFAOYSA-N
MW322.59 g/mol
LogP3.91
Rot. Bonds7

About dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane

dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane (PubChem CID 173419270) has the molecular formula C15H34O3SSi and a molecular weight of 322.59 g/mol. Its IUPAC name is dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane.

Molecular Properties

Compound Namedimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane
PubChem CID173419270
Molecular FormulaC15H34O3SSi
Molecular Weight322.59 g/mol
Exact Mass322.20
IUPAC Namedimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane
SMILESC[SiH](C)OC(OC(CC(C)(C)C)CC(C)(C)C)S(C)=O
InChIInChI=1S/C15H34O3SSi/c1-14(2,3)10-12(11-15(4,5)6)17-13(19(7)16)18-20(8)9/h12-13,20H,10-11H2,1-9H3
InChIKeyINRKCIGBVNARCQ-UHFFFAOYSA-N
XLogP3.91
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.59
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2,2-dimethylpropyl ethanesulfinate
CID 71393635
bis(2,2-dimethylpropyl) 2,3-bis(2,2-dimethylpropyl)butanedioate
CID 22241877
2,2,6,6-tetramethylheptan-4-yl formate
CID 174760926
CID 23027937
CID 23027937
2-(2,2,6,6-tetramethylheptan-4-yloxy)ethanol
CID 168837690
[(2S)-1-hydroxy-4,4-dimethylpentan-2-yl] carbamate
CID 87120669
1-methoxy-2,2-dimethylpropane
CID 160639316
1,2-dimethoxy-4,4-dimethylpentane
CID 59679444
2,2,7,7-tetramethyl-4-(2,2,7,7-tetramethyloctan-4-ylperoxy)octane
CID 175001131
[(2R)-1-hydroxy-4,4-dimethylpentan-2-yl] acetate
CID 11805240
4-tert-butyl-5-(2,2-dimethylpropyl)-2,2,7,7-tetramethyloctane
CID 153293679
1-[diethoxyphosphoryl(dimethylsilyloxy)methoxy]-4,4-dimethylpentan-2-ol
CID 173377300

Frequently Asked Questions

What is the IUPAC name of dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane?
The IUPAC name of dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane (CID 173419270) is dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane.
What is the SMILES notation for dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane?
The canonical SMILES for dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane is C[SiH](C)OC(OC(CC(C)(C)C)CC(C)(C)C)S(C)=O.
What is the InChIKey of dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane?
The InChIKey is INRKCIGBVNARCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34O3SSi/c1-14(2,3)10-12(11-15(4,5)6)17-13(19(7)16)18-20(8)9/h12-13,20H,10-11H2,1-9H3.
What are the key properties of dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane?
dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane has a molecular weight of 322.59 g/mol, XLogP of 3.91, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[methylsulfinyl(2,2,6,6-tetramethylheptan-4-yloxy)methoxy]silane is sourced from PubChem (CID 173419270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).