bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol

C28H74O6Si3 — CID 159645715

IUPACbis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol
SMILESCC.CC(C)C.CCCO.CCCOCCO.CCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCC.CCO
InChIInChI=1S/C12H32O2Si3.C5H12O2.C4H10.C3H8O.C2H6O.C2H6/c1-9-11-15(3,4)13-17(7,8)14-16(5,6)12-10-2;1-2-4-7-5-3-6;1-4(2)3;1-2-3-4;1-2-3;1-2/h9-12H2,1-8H3;6H,2-5H2,1H3;4H,1-3H3;4H,2-3H2,1H3;3H,2H2,1H3;1-2H3
InChIKeyMQXUCLTXWKMAGO-UHFFFAOYSA-N
MW591.15 g/mol
LogP8.43
Rot. Bonds13

About bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol

bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol (PubChem CID 159645715) has the molecular formula C28H74O6Si3 and a molecular weight of 591.15 g/mol. Its IUPAC name is bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol.

Molecular Properties

Compound Namebis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol
PubChem CID159645715
Molecular FormulaC28H74O6Si3
Molecular Weight591.15 g/mol
Exact Mass590.48
IUPAC Namebis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol
SMILESCC.CC(C)C.CCCO.CCCOCCO.CCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCC.CCO
InChIInChI=1S/C12H32O2Si3.C5H12O2.C4H10.C3H8O.C2H6O.C2H6/c1-9-11-15(3,4)13-17(7,8)14-16(5,6)12-10-2;1-2-4-7-5-3-6;1-4(2)3;1-2-3-4;1-2-3;1-2/h9-12H2,1-8H3;6H,2-5H2,1H3;4H,1-3H3;4H,2-3H2,1H3;3H,2H2,1H3;1-2H3
InChIKeyMQXUCLTXWKMAGO-UHFFFAOYSA-N
XLogP8.43
TPSA88.38 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500591.15
LogP ≤ 58.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

[dimethyl(propyl)silyl]oxy-[[dimethyl(propyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilane
CID 18314763
bis(propan-1-ol);bis(2-propoxyethanol)
CID 157411921
2-[3-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]propoxy]ethanol
CID 20801390
2-[3-[[[bis[3-(2-hydroxyethoxy)propyl]-methylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]ethanol
CID 59180551
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 20613004
2-[[dimethyl(trimethylsilyloxy)silyl]oxy-dimethylsilyl]ethanol;methane;propan-1-ol
CID 158735902
2-[3-[[[3-(methoxymethoxy)propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]ethanol
CID 58159183
calcium;hydride;2-propoxyethanol
CID 174734380
CID 58050979
CID 58050979
3-[[[[[[3-hydroxypropyl(dimethyl)silyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propan-1-ol
CID 90989800
2-[2-[2-[2-[2-[2-[2-[2-[2-[3-[[dimethyl(propyl)silyl]oxy-dimethylsilyloxy-methylsilyl]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 158395250
1-butoxy-3-[2-[3-[[[3-[2-(3-butoxy-2-hydroxypropoxy)ethoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]ethoxy]propan-2-ol
CID 59187881

Frequently Asked Questions

What is the IUPAC name of bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol?
The IUPAC name of bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol (CID 159645715) is bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol.
What is the SMILES notation for bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol?
The canonical SMILES for bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol is CC.CC(C)C.CCCO.CCCOCCO.CCC[Si](C)(C)O[Si](C)(C)O[Si](C)(C)CCC.CCO.
What is the InChIKey of bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol?
The InChIKey is MQXUCLTXWKMAGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H32O2Si3.C5H12O2.C4H10.C3H8O.C2H6O.C2H6/c1-9-11-15(3,4)13-17(7,8)14-16(5,6)12-10-2;1-2-4-7-5-3-6;1-4(2)3;1-2-3-4;1-2-3;1-2/h9-12H2,1-8H3;6H,2-5H2,1H3;4H,1-3H3;4H,2-3H2,1H3;3H,2H2,1H3;1-2H3.
What are the key properties of bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol?
bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol has a molecular weight of 591.15 g/mol, XLogP of 8.43, 13 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis[[dimethyl(propyl)silyl]oxy]-dimethylsilane;ethane;ethanol;2-methylpropane;propan-1-ol;2-propoxyethanol is sourced from PubChem (CID 159645715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).