2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane

C15H36OSi2 — CID 123590609

IUPAC2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane
SMILESCCCCC(C[Si](C)(C)O[Si](C)(C)C)C(C)(C)C
InChIInChI=1S/C15H36OSi2/c1-10-11-12-14(15(2,3)4)13-18(8,9)16-17(5,6)7/h14H,10-13H2,1-9H3
InChIKeyZZYPTPKOQIPZNE-UHFFFAOYSA-N
MW288.62 g/mol
LogP5.90
Rot. Bonds7

About 2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane

2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane (PubChem CID 123590609) has the molecular formula C15H36OSi2 and a molecular weight of 288.62 g/mol. Its IUPAC name is 2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane.

Molecular Properties

Compound Name2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane
PubChem CID123590609
Molecular FormulaC15H36OSi2
Molecular Weight288.62 g/mol
Exact Mass288.23
IUPAC Name2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane
SMILESCCCCC(C[Si](C)(C)O[Si](C)(C)C)C(C)(C)C
InChIInChI=1S/C15H36OSi2/c1-10-11-12-14(15(2,3)4)13-18(8,9)16-17(5,6)7/h14H,10-13H2,1-9H3
InChIKeyZZYPTPKOQIPZNE-UHFFFAOYSA-N
XLogP5.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.62
LogP ≤ 55.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane?
The IUPAC name of 2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane (CID 123590609) is 2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane.
What is the SMILES notation for 2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane?
The canonical SMILES for 2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane is CCCCC(C[Si](C)(C)O[Si](C)(C)C)C(C)(C)C.
What is the InChIKey of 2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane?
The InChIKey is ZZYPTPKOQIPZNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H36OSi2/c1-10-11-12-14(15(2,3)4)13-18(8,9)16-17(5,6)7/h14H,10-13H2,1-9H3.
What are the key properties of 2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane?
2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane has a molecular weight of 288.62 g/mol, XLogP of 5.90, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butylhexyl-dimethyl-trimethylsilyloxysilane is sourced from PubChem (CID 123590609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).