chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane

C13H37ClO3Si5 — CID 71436169

IUPACchloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane
SMILESC[Si](C)(Cl)CC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C13H37ClO3Si5/c1-18(2,3)15-22(16-19(4,5)6,17-20(7,8)9)13-12-21(10,11)14/h12-13H2,1-11H3
InChIKeyLUGNIGZCYCQQJR-UHFFFAOYSA-N
MW417.32 g/mol
LogP5.92
Rot. Bonds9

About chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane

chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane (PubChem CID 71436169) has the molecular formula C13H37ClO3Si5 and a molecular weight of 417.32 g/mol. Its IUPAC name is chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane.

Molecular Properties

Compound Namechloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane
PubChem CID71436169
Molecular FormulaC13H37ClO3Si5
Molecular Weight417.32 g/mol
Exact Mass416.13
IUPAC Namechloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane
SMILESC[Si](C)(Cl)CC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C13H37ClO3Si5/c1-18(2,3)15-22(16-19(4,5)6,17-20(7,8)9)13-12-21(10,11)14/h12-13H2,1-11H3
InChIKeyLUGNIGZCYCQQJR-UHFFFAOYSA-N
XLogP5.92
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500417.32
LogP ≤ 55.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane?
The IUPAC name of chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane (CID 71436169) is chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane.
What is the SMILES notation for chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane?
The canonical SMILES for chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane is C[Si](C)(Cl)CC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane?
The InChIKey is LUGNIGZCYCQQJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H37ClO3Si5/c1-18(2,3)15-22(16-19(4,5)6,17-20(7,8)9)13-12-21(10,11)14/h12-13H2,1-11H3.
What are the key properties of chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane?
chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane has a molecular weight of 417.32 g/mol, XLogP of 5.92, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-dimethyl-[2-tris(trimethylsilyloxy)silylethyl]silane is sourced from PubChem (CID 71436169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).