[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane

C36H86O3Si6 — CID 58944515

IUPAC[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane
SMILESCC(C(C)(CC[Si](C)(C)OC[Si](C)(C)CCC(C)(C(C)(C)O[Si](C)(C)C)C(C)(C)[Si](C)(C)C)C(C)(C)O[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C36H86O3Si6/c1-31(40(10,11)12)35(8,32(2,3)38-42(16,17)18)26-29-45(24,25)37-30-44(22,23)28-27-36(9,34(6,7)41(13,14)15)33(4,5)39-43(19,20)21/h31H,26-30H2,1-25H3
InChIKeyBDXXJOCPTBULMZ-UHFFFAOYSA-N
MW735.60 g/mol
LogP13.36
Rot. Bonds19

About [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane

[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane (PubChem CID 58944515) has the molecular formula C36H86O3Si6 and a molecular weight of 735.60 g/mol. Its IUPAC name is [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane.

Molecular Properties

Compound Name[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane
PubChem CID58944515
Molecular FormulaC36H86O3Si6
Molecular Weight735.60 g/mol
Exact Mass734.52
IUPAC Name[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane
SMILESCC(C(C)(CC[Si](C)(C)OC[Si](C)(C)CCC(C)(C(C)(C)O[Si](C)(C)C)C(C)(C)[Si](C)(C)C)C(C)(C)O[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C36H86O3Si6/c1-31(40(10,11)12)35(8,32(2,3)38-42(16,17)18)26-29-45(24,25)37-30-44(22,23)28-27-36(9,34(6,7)41(13,14)15)33(4,5)39-43(19,20)21/h31H,26-30H2,1-25H3
InChIKeyBDXXJOCPTBULMZ-UHFFFAOYSA-N
XLogP13.36
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds19
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500735.60
LogP ≤ 513.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane?
The IUPAC name of [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane (CID 58944515) is [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane.
What is the SMILES notation for [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane?
The canonical SMILES for [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane is CC(C(C)(CC[Si](C)(C)OC[Si](C)(C)CCC(C)(C(C)(C)O[Si](C)(C)C)C(C)(C)[Si](C)(C)C)C(C)(C)O[Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane?
The InChIKey is BDXXJOCPTBULMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H86O3Si6/c1-31(40(10,11)12)35(8,32(2,3)38-42(16,17)18)26-29-45(24,25)37-30-44(22,23)28-27-36(9,34(6,7)41(13,14)15)33(4,5)39-43(19,20)21/h31H,26-30H2,1-25H3.
What are the key properties of [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane?
[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane has a molecular weight of 735.60 g/mol, XLogP of 13.36, 19 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-4-trimethylsilyl-3-(2-trimethylsilyloxypropan-2-yl)pentyl]-dimethylsilyl]methoxy]-dimethylsilane is sourced from PubChem (CID 58944515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).