3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane

C20H46O4Si2 — CID 59537968

IUPAC3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane
SMILESCC(C)(C)O[SiH](CCC[Si](C)(OC(C)(C)C)OC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C20H46O4Si2/c1-17(2,3)21-25(22-18(4,5)6)15-14-16-26(13,23-19(7,8)9)24-20(10,11)12/h25H,14-16H2,1-13H3
InChIKeyWKCKAMBAHOUFBH-UHFFFAOYSA-N
MW406.76 g/mol
LogP5.93
Rot. Bonds8

About 3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane

3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane (PubChem CID 59537968) has the molecular formula C20H46O4Si2 and a molecular weight of 406.76 g/mol. Its IUPAC name is 3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane.

Molecular Properties

Compound Name3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane
PubChem CID59537968
Molecular FormulaC20H46O4Si2
Molecular Weight406.76 g/mol
Exact Mass406.29
IUPAC Name3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane
SMILESCC(C)(C)O[SiH](CCC[Si](C)(OC(C)(C)C)OC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C20H46O4Si2/c1-17(2,3)21-25(22-18(4,5)6)15-14-16-26(13,23-19(7,8)9)24-20(10,11)12/h25H,14-16H2,1-13H3
InChIKeyWKCKAMBAHOUFBH-UHFFFAOYSA-N
XLogP5.93
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.76
LogP ≤ 55.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane?
The IUPAC name of 3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane (CID 59537968) is 3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane.
What is the SMILES notation for 3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane?
The canonical SMILES for 3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane is CC(C)(C)O[SiH](CCC[Si](C)(OC(C)(C)C)OC(C)(C)C)OC(C)(C)C.
What is the InChIKey of 3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane?
The InChIKey is WKCKAMBAHOUFBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H46O4Si2/c1-17(2,3)21-25(22-18(4,5)6)15-14-16-26(13,23-19(7,8)9)24-20(10,11)12/h25H,14-16H2,1-13H3.
What are the key properties of 3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane?
3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane has a molecular weight of 406.76 g/mol, XLogP of 5.93, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[bis[(2-methylpropan-2-yl)oxy]silyl]propyl-methyl-bis[(2-methylpropan-2-yl)oxy]silane is sourced from PubChem (CID 59537968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).