[2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane

C22H50OSi2 — CID 139918654

IUPAC[2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane
SMILESCCCCC(CC)C(OC(C(CC)CCCC)[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C22H50OSi2/c1-11-15-17-19(13-3)21(24(5,6)7)23-22(25(8,9)10)20(14-4)18-16-12-2/h19-22H,11-18H2,1-10H3
InChIKeyXERRBQBSXCXBOA-UHFFFAOYSA-N
MW386.81 g/mol
LogP7.93
Rot. Bonds14

About [2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane

[2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane (PubChem CID 139918654) has the molecular formula C22H50OSi2 and a molecular weight of 386.81 g/mol. Its IUPAC name is [2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane.

Molecular Properties

Compound Name[2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane
PubChem CID139918654
Molecular FormulaC22H50OSi2
Molecular Weight386.81 g/mol
Exact Mass386.34
IUPAC Name[2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane
SMILESCCCCC(CC)C(OC(C(CC)CCCC)[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C22H50OSi2/c1-11-15-17-19(13-3)21(24(5,6)7)23-22(25(8,9)10)20(14-4)18-16-12-2/h19-22H,11-18H2,1-10H3
InChIKeyXERRBQBSXCXBOA-UHFFFAOYSA-N
XLogP7.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.81
LogP ≤ 57.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 [2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane?
The IUPAC name of [2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane (CID 139918654) is [2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane.
What is the SMILES notation for [2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane?
The canonical SMILES for [2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane is CCCCC(CC)C(OC(C(CC)CCCC)[Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of [2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane?
The InChIKey is XERRBQBSXCXBOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H50OSi2/c1-11-15-17-19(13-3)21(24(5,6)7)23-22(25(8,9)10)20(14-4)18-16-12-2/h19-22H,11-18H2,1-10H3.
What are the key properties of [2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane?
[2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane has a molecular weight of 386.81 g/mol, XLogP of 7.93, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethyl-1-(2-ethyl-1-trimethylsilylhexoxy)hexyl]-trimethylsilane is sourced from PubChem (CID 139918654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).