2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane

C8H18Cl2O2Si — CID 91700683

IUPAC2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane
SMILESCC(C)CO[Si](C)(C)OCC(Cl)Cl
InChIInChI=1S/C8H18Cl2O2Si/c1-7(2)5-11-13(3,4)12-6-8(9)10/h7-8H,5-6H2,1-4H3
InChIKeyUHXUNHITRPKEPL-UHFFFAOYSA-N
MW245.22 g/mol
LogP3.18
Rot. Bonds6

About 2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane

2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane (PubChem CID 91700683) has the molecular formula C8H18Cl2O2Si and a molecular weight of 245.22 g/mol. Its IUPAC name is 2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane.

Molecular Properties

Compound Name2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane
PubChem CID91700683
Molecular FormulaC8H18Cl2O2Si
Molecular Weight245.22 g/mol
Exact Mass244.05
IUPAC Name2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane
SMILESCC(C)CO[Si](C)(C)OCC(Cl)Cl
InChIInChI=1S/C8H18Cl2O2Si/c1-7(2)5-11-13(3,4)12-6-8(9)10/h7-8H,5-6H2,1-4H3
InChIKeyUHXUNHITRPKEPL-UHFFFAOYSA-N
XLogP3.18
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.22
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane?
The IUPAC name of 2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane (CID 91700683) is 2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane.
What is the SMILES notation for 2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane?
The canonical SMILES for 2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane is CC(C)CO[Si](C)(C)OCC(Cl)Cl.
What is the InChIKey of 2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane?
The InChIKey is UHXUNHITRPKEPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18Cl2O2Si/c1-7(2)5-11-13(3,4)12-6-8(9)10/h7-8H,5-6H2,1-4H3.
What are the key properties of 2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane?
2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane has a molecular weight of 245.22 g/mol, XLogP of 3.18, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dichloroethoxy-dimethyl-(2-methylpropoxy)silane is sourced from PubChem (CID 91700683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).