[bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane

C23H52O4Si2 — CID 87143678

IUPAC[bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane
SMILESCCC[Si](C[Si](CCC)(OC(C)(C)C)OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C23H52O4Si2/c1-15-17-28(24-20(3,4)5,25-21(6,7)8)19-29(18-16-2,26-22(9,10)11)27-23(12,13)14/h15-19H2,1-14H3
InChIKeyMPTFAXJWVWWYLB-UHFFFAOYSA-N
MW448.84 g/mol
LogP7.49
Rot. Bonds10

About [bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane

[bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane (PubChem CID 87143678) has the molecular formula C23H52O4Si2 and a molecular weight of 448.84 g/mol. Its IUPAC name is [bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane.

Molecular Properties

Compound Name[bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane
PubChem CID87143678
Molecular FormulaC23H52O4Si2
Molecular Weight448.84 g/mol
Exact Mass448.34
IUPAC Name[bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane
SMILESCCC[Si](C[Si](CCC)(OC(C)(C)C)OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C23H52O4Si2/c1-15-17-28(24-20(3,4)5,25-21(6,7)8)19-29(18-16-2,26-22(9,10)11)27-23(12,13)14/h15-19H2,1-14H3
InChIKeyMPTFAXJWVWWYLB-UHFFFAOYSA-N
XLogP7.49
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.84
LogP ≤ 57.49
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 [bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane?
The IUPAC name of [bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane (CID 87143678) is [bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane.
What is the SMILES notation for [bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane?
The canonical SMILES for [bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane is CCC[Si](C[Si](CCC)(OC(C)(C)C)OC(C)(C)C)(OC(C)(C)C)OC(C)(C)C.
What is the InChIKey of [bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane?
The InChIKey is MPTFAXJWVWWYLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H52O4Si2/c1-15-17-28(24-20(3,4)5,25-21(6,7)8)19-29(18-16-2,26-22(9,10)11)27-23(12,13)14/h15-19H2,1-14H3.
What are the key properties of [bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane?
[bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane has a molecular weight of 448.84 g/mol, XLogP of 7.49, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [bis[(2-methylpropan-2-yl)oxy]-propylsilyl]methyl-bis[(2-methylpropan-2-yl)oxy]-propylsilane is sourced from PubChem (CID 87143678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).