dodecoxy-hexan-2-yloxy-dimethylsilane

C20H44O2Si — CID 91741105

IUPACdodecoxy-hexan-2-yloxy-dimethylsilane
SMILESCCCCCCCCCCCCO[Si](C)(C)OC(C)CCCC
InChIInChI=1S/C20H44O2Si/c1-6-8-10-11-12-13-14-15-16-17-19-21-23(4,5)22-20(3)18-9-7-2/h20H,6-19H2,1-5H3
InChIKeySHYROAIGLQCGET-UHFFFAOYSA-N
MW344.66 g/mol
LogP7.22
Rot. Bonds17

About dodecoxy-hexan-2-yloxy-dimethylsilane

dodecoxy-hexan-2-yloxy-dimethylsilane (PubChem CID 91741105) has the molecular formula C20H44O2Si and a molecular weight of 344.66 g/mol. Its IUPAC name is dodecoxy-hexan-2-yloxy-dimethylsilane.

Molecular Properties

Compound Namedodecoxy-hexan-2-yloxy-dimethylsilane
PubChem CID91741105
Molecular FormulaC20H44O2Si
Molecular Weight344.66 g/mol
Exact Mass344.31
IUPAC Namedodecoxy-hexan-2-yloxy-dimethylsilane
SMILESCCCCCCCCCCCCO[Si](C)(C)OC(C)CCCC
InChIInChI=1S/C20H44O2Si/c1-6-8-10-11-12-13-14-15-16-17-19-21-23(4,5)22-20(3)18-9-7-2/h20H,6-19H2,1-5H3
InChIKeySHYROAIGLQCGET-UHFFFAOYSA-N
XLogP7.22
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds17
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.66
LogP ≤ 57.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze dodecoxy-hexan-2-yloxy-dimethylsilane with MolForge

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

Launch Full Analysis

Related Compounds

dimethyl-octoxy-pentan-2-yloxysilane
CID 91736775
butoxy-dimethyl-pentan-2-yloxysilane
CID 91726705
dimethyl-(2-methylpropoxy)-octan-2-yloxysilane
CID 91726674
hexoxy-dimethyl-nonoxysilane
CID 91741085
hexoxy-dimethyl-undecoxysilane
CID 91742305
hexadecoxy-dimethyl-(4-methylpentoxy)silane
CID 91744434
heptoxy-dimethyl-(4-methylpentoxy)silane
CID 91739178
heptoxy-dimethyl-(2-methylpropoxy)silane
CID 91736684
docosoxy-dimethyl-(2-methylpropoxy)silane
CID 91745391
diethyl-octadecoxy-pentan-2-yloxysilane
CID 91744997
diethoxy-hexadecan-2-yloxy-methylsilane
CID 176915381
hexan-2-yloxy-octoxy-diphenylsilane
CID 91742037

Frequently Asked Questions

What is the IUPAC name of dodecoxy-hexan-2-yloxy-dimethylsilane?
The IUPAC name of dodecoxy-hexan-2-yloxy-dimethylsilane (CID 91741105) is dodecoxy-hexan-2-yloxy-dimethylsilane.
What is the SMILES notation for dodecoxy-hexan-2-yloxy-dimethylsilane?
The canonical SMILES for dodecoxy-hexan-2-yloxy-dimethylsilane is CCCCCCCCCCCCO[Si](C)(C)OC(C)CCCC.
What is the InChIKey of dodecoxy-hexan-2-yloxy-dimethylsilane?
The InChIKey is SHYROAIGLQCGET-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H44O2Si/c1-6-8-10-11-12-13-14-15-16-17-19-21-23(4,5)22-20(3)18-9-7-2/h20H,6-19H2,1-5H3.
What are the key properties of dodecoxy-hexan-2-yloxy-dimethylsilane?
dodecoxy-hexan-2-yloxy-dimethylsilane has a molecular weight of 344.66 g/mol, XLogP of 7.22, 17 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dodecoxy-hexan-2-yloxy-dimethylsilane is sourced from PubChem (CID 91741105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).