dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane

C26H54O6Si5 — CID 91278748

IUPACdimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane
SMILESC#CC(C)(C)O[Si](C)(C)OC(C)(C)C#C.C#CC(C)(C)O[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C14H34O4Si4.C12H20O2Si/c1-13-14(2,3)15-22(12,17-20(7,8)9)18-21(10,11)16-19(4,5)6;1-9-11(3,4)13-15(7,8)14-12(5,6)10-2/h1H,2-12H3;1-2H,3-8H3
InChIKeyJLAWFLHQISVIFW-UHFFFAOYSA-N
MW603.14 g/mol
LogP6.95
Rot. Bonds12

About dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane

dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane (PubChem CID 91278748) has the molecular formula C26H54O6Si5 and a molecular weight of 603.14 g/mol. Its IUPAC name is dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane.

Molecular Properties

Compound Namedimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane
PubChem CID91278748
Molecular FormulaC26H54O6Si5
Molecular Weight603.14 g/mol
Exact Mass602.28
IUPAC Namedimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane
SMILESC#CC(C)(C)O[Si](C)(C)OC(C)(C)C#C.C#CC(C)(C)O[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C14H34O4Si4.C12H20O2Si/c1-13-14(2,3)15-22(12,17-20(7,8)9)18-21(10,11)16-19(4,5)6;1-9-11(3,4)13-15(7,8)14-12(5,6)10-2/h1H,2-12H3;1-2H,3-8H3
InChIKeyJLAWFLHQISVIFW-UHFFFAOYSA-N
XLogP6.95
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500603.14
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

Silane, tris((1,1-dimethyl-2-propyn-1-yl)oxy)methyl-
CID 174339
Bis(1,1-dimethyl-2-propynyloxy)dimethylsilane
CID 155887695
Bis[(1,1-dimethyl-2-propyn-1-yl)oxy]dimethylsilane
CID 11117702
(2,5-Dimethyl-5-trimethylsilyloxyhex-3-yn-2-yl)oxy-trimethylsilane
CID 20071839
2,2,4,4,7,7,9,9,11,11,14,14-Dodecamethyl-1,3,8,10-tetraoxa-2,9-disilacyclotetradeca-5,12-diyne
CID 5251012
Trimethyl-[2-methyl-5-trimethylsilyloxy-5-tri(propan-2-yl)stannylhex-3-yn-2-yl]oxysilane
CID 15271676
(3,6-Diethynyl-3,6-dimethoxy-8-triethylsilylocta-1,4,7-triynyl)-triethylsilane
CID 102086370
Tert-butyl-[4-[tert-butyl(dimethyl)silyl]oxy-3,4-dimethylhexa-1,5-diyn-3-yl]oxy-dimethylsilane
CID 10959526
Methyl-[[methyl-bis[(2-methylpropan-2-yl)oxy]silyl]methyl]-bis[(2-methylpropan-2-yl)oxy]silane
CID 18769713
Dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane
CID 20677691
(2,5-Dimethyl-5-trimethylsilylperoxyhex-3-yn-2-yl)peroxy-trimethylsilane
CID 22571192
Methyl-bis[(2-methylpropan-2-yl)oxy]-[tris[(2-methylpropan-2-yl)oxy]silylmethyl]silane
CID 22706815

Frequently Asked Questions

What is the IUPAC name of dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane?
The IUPAC name of dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane (CID 91278748) is dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane.
What is the SMILES notation for dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane?
The canonical SMILES for dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane is C#CC(C)(C)O[Si](C)(C)OC(C)(C)C#C.C#CC(C)(C)O[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C.
What is the InChIKey of dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane?
The InChIKey is JLAWFLHQISVIFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H34O4Si4.C12H20O2Si/c1-13-14(2,3)15-22(12,17-20(7,8)9)18-21(10,11)16-19(4,5)6;1-9-11(3,4)13-15(7,8)14-12(5,6)10-2/h1H,2-12H3;1-2H,3-8H3.
What are the key properties of dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane?
dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane has a molecular weight of 603.14 g/mol, XLogP of 6.95, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(2-methylbut-3-yn-2-yloxy)silane;dimethyl-[methyl-(2-methylbut-3-yn-2-yloxy)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane is sourced from PubChem (CID 91278748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).