[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane

C35H84O3Si6 — CID 23557587

IUPAC[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane
SMILESCC(C(C)(CC[Si](C)(C)CO[Si](C)(C)CCC(C)(C(C)[Si](C)(C)C)C(C)(C)O[Si](C)(C)C)C(C)(C)O[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C35H84O3Si6/c1-30(39(9,10)11)34(7,32(3,4)37-41(15,16)17)25-27-43(21,22)29-36-44(23,24)28-26-35(8,31(2)40(12,13)14)33(5,6)38-42(18,19)20/h30-31H,25-29H2,1-24H3
InChIKeyJSVIFRQPEOCIEB-UHFFFAOYSA-N
MW721.57 g/mol
LogP12.97
Rot. Bonds19

About [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane

[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane (PubChem CID 23557587) has the molecular formula C35H84O3Si6 and a molecular weight of 721.57 g/mol. Its IUPAC name is [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane.

Molecular Properties

Compound Name[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane
PubChem CID23557587
Molecular FormulaC35H84O3Si6
Molecular Weight721.57 g/mol
Exact Mass720.50
IUPAC Name[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane
SMILESCC(C(C)(CC[Si](C)(C)CO[Si](C)(C)CCC(C)(C(C)[Si](C)(C)C)C(C)(C)O[Si](C)(C)C)C(C)(C)O[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C35H84O3Si6/c1-30(39(9,10)11)34(7,32(3,4)37-41(15,16)17)25-27-43(21,22)29-36-44(23,24)28-26-35(8,31(2)40(12,13)14)33(5,6)38-42(18,19)20/h30-31H,25-29H2,1-24H3
InChIKeyJSVIFRQPEOCIEB-UHFFFAOYSA-N
XLogP12.97
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds19
Heavy Atoms44
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500721.57
LogP ≤ 512.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane?
The IUPAC name of [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane (CID 23557587) is [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane.
What is the SMILES notation for [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane?
The canonical SMILES for [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane is CC(C(C)(CC[Si](C)(C)CO[Si](C)(C)CCC(C)(C(C)[Si](C)(C)C)C(C)(C)O[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-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane?
The InChIKey is JSVIFRQPEOCIEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H84O3Si6/c1-30(39(9,10)11)34(7,32(3,4)37-41(15,16)17)25-27-43(21,22)29-36-44(23,24)28-26-35(8,31(2)40(12,13)14)33(5,6)38-42(18,19)20/h30-31H,25-29H2,1-24H3.
What are the key properties of [3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane?
[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-[[[3,4-dimethyl-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane has a molecular weight of 721.57 g/mol, XLogP of 12.97, 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-3-(1-trimethylsilylethyl)-4-trimethylsilyloxypentyl]-dimethylsilyl]methoxy]-dimethylsilane is sourced from PubChem (CID 23557587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).