butoxy-(2,2-dichloroethoxy)-dimethylsilane

C8H18Cl2O2Si — CID 91700669

IUPACbutoxy-(2,2-dichloroethoxy)-dimethylsilane
SMILESCCCCO[Si](C)(C)OCC(Cl)Cl
InChIInChI=1S/C8H18Cl2O2Si/c1-4-5-6-11-13(2,3)12-7-8(9)10/h8H,4-7H2,1-3H3
InChIKeyNOPLHUJAAHDWOB-UHFFFAOYSA-N
MW245.22 g/mol
LogP3.33
Rot. Bonds7

About butoxy-(2,2-dichloroethoxy)-dimethylsilane

butoxy-(2,2-dichloroethoxy)-dimethylsilane (PubChem CID 91700669) has the molecular formula C8H18Cl2O2Si and a molecular weight of 245.22 g/mol. Its IUPAC name is butoxy-(2,2-dichloroethoxy)-dimethylsilane.

Molecular Properties

Compound Namebutoxy-(2,2-dichloroethoxy)-dimethylsilane
PubChem CID91700669
Molecular FormulaC8H18Cl2O2Si
Molecular Weight245.22 g/mol
Exact Mass244.05
IUPAC Namebutoxy-(2,2-dichloroethoxy)-dimethylsilane
SMILESCCCCO[Si](C)(C)OCC(Cl)Cl
InChIInChI=1S/C8H18Cl2O2Si/c1-4-5-6-11-13(2,3)12-7-8(9)10/h8H,4-7H2,1-3H3
InChIKeyNOPLHUJAAHDWOB-UHFFFAOYSA-N
XLogP3.33
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.22
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze butoxy-(2,2-dichloroethoxy)-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

Silane, (2,2-dichloroethoxy)(1,1-dimethylethyl)dimethyl-
CID 13054793
Di(4-chlorobutoxy)dimethylsilane
CID 15185643
Silane, dimethyl(2,2,2-trichloroethoxy)pentyloxy-
CID 91700561
Silane, dimethyl(2,2-dichloroethoxy)propoxy-
CID 91700668
Silane, dimethyl(2,2-dichloroethoxy)isobutoxy-
CID 91700683
Silane, dimethyl(2,2-dichloroethoxy)ethoxy-
CID 91711777
Silane, dimethyl(2-chloropropoxy)propoxy-
CID 91719373
Silane, dimethyldi(2-chloropropoxy)-
CID 91721077
Silane, dimethyl(2-chloropropoxy)butoxy-
CID 91723713
Ethoxyethane;trimethyl(1,1,2-trichloroethoxy)silane
CID 87409204
4-Chlorobutoxy-bis(2-chloroethyl)-methoxysilane
CID 88753819
Tributoxy(2,2-dichloroethyl)silane
CID 140332392

Frequently Asked Questions

What is the IUPAC name of butoxy-(2,2-dichloroethoxy)-dimethylsilane?
The IUPAC name of butoxy-(2,2-dichloroethoxy)-dimethylsilane (CID 91700669) is butoxy-(2,2-dichloroethoxy)-dimethylsilane.
What is the SMILES notation for butoxy-(2,2-dichloroethoxy)-dimethylsilane?
The canonical SMILES for butoxy-(2,2-dichloroethoxy)-dimethylsilane is CCCCO[Si](C)(C)OCC(Cl)Cl.
What is the InChIKey of butoxy-(2,2-dichloroethoxy)-dimethylsilane?
The InChIKey is NOPLHUJAAHDWOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18Cl2O2Si/c1-4-5-6-11-13(2,3)12-7-8(9)10/h8H,4-7H2,1-3H3.
What are the key properties of butoxy-(2,2-dichloroethoxy)-dimethylsilane?
butoxy-(2,2-dichloroethoxy)-dimethylsilane has a molecular weight of 245.22 g/mol, XLogP of 3.33, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-(2,2-dichloroethoxy)-dimethylsilane is sourced from PubChem (CID 91700669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).