2,2-dichloroethoxy-dimethyl-propoxysilane

C7H16Cl2O2Si — CID 91700668

IUPAC2,2-dichloroethoxy-dimethyl-propoxysilane
SMILESCCCO[Si](C)(C)OCC(Cl)Cl
InChIInChI=1S/C7H16Cl2O2Si/c1-4-5-10-12(2,3)11-6-7(8)9/h7H,4-6H2,1-3H3
InChIKeyQNRPSLILHWQIDB-UHFFFAOYSA-N
MW231.19 g/mol
LogP2.94
Rot. Bonds6

About 2,2-dichloroethoxy-dimethyl-propoxysilane

2,2-dichloroethoxy-dimethyl-propoxysilane (PubChem CID 91700668) has the molecular formula C7H16Cl2O2Si and a molecular weight of 231.19 g/mol. Its IUPAC name is 2,2-dichloroethoxy-dimethyl-propoxysilane.

Molecular Properties

Compound Name2,2-dichloroethoxy-dimethyl-propoxysilane
PubChem CID91700668
Molecular FormulaC7H16Cl2O2Si
Molecular Weight231.19 g/mol
Exact Mass230.03
IUPAC Name2,2-dichloroethoxy-dimethyl-propoxysilane
SMILESCCCO[Si](C)(C)OCC(Cl)Cl
InChIInChI=1S/C7H16Cl2O2Si/c1-4-5-10-12(2,3)11-6-7(8)9/h7H,4-6H2,1-3H3
InChIKeyQNRPSLILHWQIDB-UHFFFAOYSA-N
XLogP2.94
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.19
LogP ≤ 52.94
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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Related Compounds

Bis(2-chloroethoxy)dimethylsilane
CID 87468
Silane, (2,2-dichloroethoxy)(1,1-dimethylethyl)dimethyl-
CID 13054793
(2,2-Dichloroethoxy)(trimethyl)silane
CID 71366239
Tris(2-chloroethoxy)methylsilane
CID 81205
Bis(2-chloroethoxy)methylsilane
CID 6335367
Silane, dimethyldi(2,2-dichloroethoxy)-
CID 91700393
Silane, dimethyl(2,2,2-trichloroethoxy)propoxy-
CID 91700564
Silane, dimethyl(2,2-dichloroethoxy)butoxy-
CID 91700669
Silane, dimethyl(2,2-dichloroethoxy)isobutoxy-
CID 91700683
Silane, dimethyl(2,2,2-trichloroethoxy)ethoxy-
CID 91711736
Silane, dimethyl(2,2-dichloroethoxy)ethoxy-
CID 91711777
Silane, dimethyl(2-chloropropoxy)propoxy-
CID 91719373

Frequently Asked Questions

What is the IUPAC name of 2,2-dichloroethoxy-dimethyl-propoxysilane?
The IUPAC name of 2,2-dichloroethoxy-dimethyl-propoxysilane (CID 91700668) is 2,2-dichloroethoxy-dimethyl-propoxysilane.
What is the SMILES notation for 2,2-dichloroethoxy-dimethyl-propoxysilane?
The canonical SMILES for 2,2-dichloroethoxy-dimethyl-propoxysilane is CCCO[Si](C)(C)OCC(Cl)Cl.
What is the InChIKey of 2,2-dichloroethoxy-dimethyl-propoxysilane?
The InChIKey is QNRPSLILHWQIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16Cl2O2Si/c1-4-5-10-12(2,3)11-6-7(8)9/h7H,4-6H2,1-3H3.
What are the key properties of 2,2-dichloroethoxy-dimethyl-propoxysilane?
2,2-dichloroethoxy-dimethyl-propoxysilane has a molecular weight of 231.19 g/mol, XLogP of 2.94, 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-propoxysilane is sourced from PubChem (CID 91700668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).