diethoxy-methyl-(1,2,2-trichloroethenyl)silane

C7H13Cl3O2Si — CID 583893

IUPACdiethoxy-methyl-(1,2,2-trichloroethenyl)silane
SMILESCCO[Si](C)(OCC)C(Cl)=C(Cl)Cl
InChIInChI=1S/C7H13Cl3O2Si/c1-4-11-13(3,12-5-2)7(10)6(8)9/h4-5H2,1-3H3
InChIKeyCIVBPRWODZMZPA-UHFFFAOYSA-N
MW263.62 g/mol
LogP3.56
Rot. Bonds5

About diethoxy-methyl-(1,2,2-trichloroethenyl)silane

diethoxy-methyl-(1,2,2-trichloroethenyl)silane (PubChem CID 583893) has the molecular formula C7H13Cl3O2Si and a molecular weight of 263.62 g/mol. Its IUPAC name is diethoxy-methyl-(1,2,2-trichloroethenyl)silane.

Molecular Properties

Compound Namediethoxy-methyl-(1,2,2-trichloroethenyl)silane
PubChem CID583893
Molecular FormulaC7H13Cl3O2Si
Molecular Weight263.62 g/mol
Exact Mass261.98
IUPAC Namediethoxy-methyl-(1,2,2-trichloroethenyl)silane
SMILESCCO[Si](C)(OCC)C(Cl)=C(Cl)Cl
InChIInChI=1S/C7H13Cl3O2Si/c1-4-11-13(3,12-5-2)7(10)6(8)9/h4-5H2,1-3H3
InChIKeyCIVBPRWODZMZPA-UHFFFAOYSA-N
XLogP3.56
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.62
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Trimethyl(2,2,2-trichloroethoxy)silane
CID 12486601
Silane, dimethyldi(2,2,2-trichloroethoxy)-
CID 91700335
Silane, dimethyl(2,2,2-trichloroethoxy)propoxy-
CID 91700564
Silane, dimethyl(2,2,2-trichloroethoxy)ethoxy-
CID 91711736
Silane, bis[(2,2-dichloroethenyl)oxy]dimethyl-
CID 10902050
[(2,2-Dichloroethenyl)oxy](trimethyl)silane
CID 12730147
(Trichlorovinyl)triethoxysilane
CID 592811
2-Methoxyethoxy-methyl-(2,2,2-trichloroethylidene)silane
CID 91111882
Ethoxy-methyl-(2,2,2-trichloroethylidene)silane
CID 91479556
2,2-Dichloroethyl-ethoxy-dimethylsilane
CID 141278301
2,2-Dichloropropyl-dimethoxy-methylsilane
CID 149844876
Triethoxy(2,2,2-trichloroethyl)silane
CID 150275657

Frequently Asked Questions

What is the IUPAC name of diethoxy-methyl-(1,2,2-trichloroethenyl)silane?
The IUPAC name of diethoxy-methyl-(1,2,2-trichloroethenyl)silane (CID 583893) is diethoxy-methyl-(1,2,2-trichloroethenyl)silane.
What is the SMILES notation for diethoxy-methyl-(1,2,2-trichloroethenyl)silane?
The canonical SMILES for diethoxy-methyl-(1,2,2-trichloroethenyl)silane is CCO[Si](C)(OCC)C(Cl)=C(Cl)Cl.
What is the InChIKey of diethoxy-methyl-(1,2,2-trichloroethenyl)silane?
The InChIKey is CIVBPRWODZMZPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13Cl3O2Si/c1-4-11-13(3,12-5-2)7(10)6(8)9/h4-5H2,1-3H3.
What are the key properties of diethoxy-methyl-(1,2,2-trichloroethenyl)silane?
diethoxy-methyl-(1,2,2-trichloroethenyl)silane has a molecular weight of 263.62 g/mol, XLogP of 3.56, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-methyl-(1,2,2-trichloroethenyl)silane is sourced from PubChem (CID 583893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).