chloro(1-chloroethoxy)silane

C2H6Cl2OSi — CID 123387265

IUPACchloro(1-chloroethoxy)silane
SMILESCC(Cl)O[SiH2]Cl
InChIInChI=1S/C2H6Cl2OSi/c1-2(3)5-6-4/h2H,6H2,1H3
InChIKeyIDJSOYILNYTEDI-UHFFFAOYSA-N
MW145.06 g/mol
LogP0.83
Rot. Bonds2

About chloro(1-chloroethoxy)silane

chloro(1-chloroethoxy)silane (PubChem CID 123387265) has the molecular formula C2H6Cl2OSi and a molecular weight of 145.06 g/mol. Its IUPAC name is chloro(1-chloroethoxy)silane.

Molecular Properties

Compound Namechloro(1-chloroethoxy)silane
PubChem CID123387265
Molecular FormulaC2H6Cl2OSi
Molecular Weight145.06 g/mol
Exact Mass143.96
IUPAC Namechloro(1-chloroethoxy)silane
SMILESCC(Cl)O[SiH2]Cl
InChIInChI=1S/C2H6Cl2OSi/c1-2(3)5-6-4/h2H,6H2,1H3
InChIKeyIDJSOYILNYTEDI-UHFFFAOYSA-N
XLogP0.83
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.06
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

CID 71329388
CID 71329388
CID 123967152
CID 123967152
CID 153696047
CID 153696047
CID 153956150
CID 153956150
CID 173208950
CID 173208950
CID 173373451
CID 173373451
CID 23045874
CID 23045874

Frequently Asked Questions

What is the IUPAC name of chloro(1-chloroethoxy)silane?
The IUPAC name of chloro(1-chloroethoxy)silane (CID 123387265) is chloro(1-chloroethoxy)silane.
What is the SMILES notation for chloro(1-chloroethoxy)silane?
The canonical SMILES for chloro(1-chloroethoxy)silane is CC(Cl)O[SiH2]Cl.
What is the InChIKey of chloro(1-chloroethoxy)silane?
The InChIKey is IDJSOYILNYTEDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6Cl2OSi/c1-2(3)5-6-4/h2H,6H2,1H3.
What are the key properties of chloro(1-chloroethoxy)silane?
chloro(1-chloroethoxy)silane has a molecular weight of 145.06 g/mol, XLogP of 0.83, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(1-chloroethoxy)silane is sourced from PubChem (CID 123387265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).