3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane

C20H46OSi2 — CID 123963569

IUPAC3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane
SMILESCCCCC(C)(C)[Si](C)(C)OC(C)(C)[Si](C)(C)CCC(C)(C)C
InChIInChI=1S/C20H46OSi2/c1-13-14-15-19(5,6)23(11,12)21-20(7,8)22(9,10)17-16-18(2,3)4/h13-17H2,1-12H3
InChIKeyDMZIPVLFHBGBFA-UHFFFAOYSA-N
MW358.76 g/mol
LogP7.64
Rot. Bonds9

About 3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane

3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane (PubChem CID 123963569) has the molecular formula C20H46OSi2 and a molecular weight of 358.76 g/mol. Its IUPAC name is 3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane.

Molecular Properties

Compound Name3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane
PubChem CID123963569
Molecular FormulaC20H46OSi2
Molecular Weight358.76 g/mol
Exact Mass358.31
IUPAC Name3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane
SMILESCCCCC(C)(C)[Si](C)(C)OC(C)(C)[Si](C)(C)CCC(C)(C)C
InChIInChI=1S/C20H46OSi2/c1-13-14-15-19(5,6)23(11,12)21-20(7,8)22(9,10)17-16-18(2,3)4/h13-17H2,1-12H3
InChIKeyDMZIPVLFHBGBFA-UHFFFAOYSA-N
XLogP7.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.76
LogP ≤ 57.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Bis-tertiarybutyldimethylsilylether
CID 129719412
Trimethyl-(2,2,4-trimethyl-4-trimethylsilyloxypentyl)silane
CID 18714493
Trimethyl-(2,2,4-trimethyl-1-trimethylsilylheptan-4-yl)oxysilane
CID 18716500
Trimethyl-(2,3,3,4-tetramethyl-4-trimethylsilylhexan-2-yl)oxysilane
CID 20603291
Trimethyl-(3,5,5-trimethyl-6-trimethylsilylhexan-3-yl)oxysilane
CID 58309977
Ethyl-[4-[[ethyl(dimethyl)silyl]methyl]-2,4-dimethylhexan-2-yl]oxy-dimethylsilane
CID 58607507
Ethoxy-[5-[ethoxy(dimethyl)silyl]-2,2,4,4-tetramethylpentyl]-dimethylsilane
CID 59364657
3-[Dimethyl(2,2,3-trimethylpentan-3-yl)silyl]oxypentan-3-yl-trimethylsilane
CID 89799778
4,4-Dimethylpentan-2-yl-[2-[1-[dimethyl(pentan-2-yl)silyl]oxyethyl-dimethylsilyl]oxypropan-2-yl]-dimethylsilane
CID 91391789
3,4-Diethylhexan-3-yl-(1-ethyl-1-trimethylsilylpropoxy)-dimethylsilane
CID 123137843
Dimethyl-(2-methylhexan-2-yl)-(2-methylsilylpropan-2-yloxy)silane
CID 123206827
Dimethyl-(2-methylhexan-2-yl)-(2-trimethylsilylpropan-2-yloxy)silane
CID 123502918

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane?
The IUPAC name of 3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane (CID 123963569) is 3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane.
What is the SMILES notation for 3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane?
The canonical SMILES for 3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane is CCCCC(C)(C)[Si](C)(C)OC(C)(C)[Si](C)(C)CCC(C)(C)C.
What is the InChIKey of 3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane?
The InChIKey is DMZIPVLFHBGBFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H46OSi2/c1-13-14-15-19(5,6)23(11,12)21-20(7,8)22(9,10)17-16-18(2,3)4/h13-17H2,1-12H3.
What are the key properties of 3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane?
3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane has a molecular weight of 358.76 g/mol, XLogP of 7.64, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethylbutyl-[2-[dimethyl(2-methylhexan-2-yl)silyl]oxypropan-2-yl]-dimethylsilane is sourced from PubChem (CID 123963569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).