[dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane

C17H42O4Si3 — CID 91736049

IUPAC[dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane
SMILESCCC(C)CO[Si](C)(C)O[Si](C)(C)O[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C17H42O4Si3/c1-11-17(4)15-19-23(7,8)21-24(9,10)20-22(5,6)18-14-12-13-16(2)3/h16-17H,11-15H2,1-10H3
InChIKeyHFLOHCUNMJMGCI-UHFFFAOYSA-N
MW394.78 g/mol
LogP5.64
Rot. Bonds13

About [dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane

[dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane (PubChem CID 91736049) has the molecular formula C17H42O4Si3 and a molecular weight of 394.78 g/mol. Its IUPAC name is [dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane.

Molecular Properties

Compound Name[dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane
PubChem CID91736049
Molecular FormulaC17H42O4Si3
Molecular Weight394.78 g/mol
Exact Mass394.24
IUPAC Name[dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane
SMILESCCC(C)CO[Si](C)(C)O[Si](C)(C)O[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C17H42O4Si3/c1-11-17(4)15-19-23(7,8)21-24(9,10)20-22(5,6)18-14-12-13-16(2)3/h16-17H,11-15H2,1-10H3
InChIKeyHFLOHCUNMJMGCI-UHFFFAOYSA-N
XLogP5.64
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.78
LogP ≤ 55.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

Trimethyl-[2-(trimethylsilyloxymethyl)pentoxy]silane
CID 134895252
Silane, dimethyldi(3-methylpentyloxy)-
CID 14388494
1,7-Di(2-methylbutyl)-2,2,4,4,6,6-hexamethyl-1,3,5,7-tetraoxa-2,4,6-trisilaheptane
CID 91696082
Dimethylpyrrolbis[(2-methylpentyl)oxy]morphosilane
CID 91697347
Silane, dimethylisobutoxyisohexyloxy-
CID 91698388
Silane, dimethyl(2-methylbutoxy)isohexyloxy-
CID 91698394
Silane, dimethyldiisohexyloxy-
CID 91698398
Silane, dimethyl(3-methylpentyloxy)isohexyloxy-
CID 91698399
Silane, diethylisohexyloxy(2-methylbutoxy)-
CID 91698400
Silane, diethylisohexyloxy(4-methylpent-2-yloxy)-
CID 91698408
Silane, dimethyl(dimethyl(2-ethylhexyloxy)silyloxy)isobutoxy-
CID 91721103
Silane, dimethyl(dimethyl(2-methylbutoxy)silyloxy)isohexyloxy-
CID 91721105

Frequently Asked Questions

What is the IUPAC name of [dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane?
The IUPAC name of [dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane (CID 91736049) is [dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane.
What is the SMILES notation for [dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane?
The canonical SMILES for [dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane is CCC(C)CO[Si](C)(C)O[Si](C)(C)O[Si](C)(C)OCCCC(C)C.
What is the InChIKey of [dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane?
The InChIKey is HFLOHCUNMJMGCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H42O4Si3/c1-11-17(4)15-19-23(7,8)21-24(9,10)20-22(5,6)18-14-12-13-16(2)3/h16-17H,11-15H2,1-10H3.
What are the key properties of [dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane?
[dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane has a molecular weight of 394.78 g/mol, XLogP of 5.64, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(2-methylbutoxy)silyl]oxy-[dimethyl(4-methylpentoxy)silyl]oxy-dimethylsilane is sourced from PubChem (CID 91736049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).