chloroethane;diethoxysilane

C6H17ClO2Si — CID 158437501

IUPACchloroethane;diethoxysilane
SMILESCCCl.CCO[SiH2]OCC
InChIInChI=1S/C4H12O2Si.C2H5Cl/c1-3-5-7-6-4-2;1-2-3/h3-4,7H2,1-2H3;2H2,1H3
InChIKeyHCKJKYDQMMJUFO-UHFFFAOYSA-N
MW184.74 g/mol
LogP1.30
Rot. Bonds4

About chloroethane;diethoxysilane

chloroethane;diethoxysilane (PubChem CID 158437501) has the molecular formula C6H17ClO2Si and a molecular weight of 184.74 g/mol. Its IUPAC name is chloroethane;diethoxysilane.

Molecular Properties

Compound Namechloroethane;diethoxysilane
PubChem CID158437501
Molecular FormulaC6H17ClO2Si
Molecular Weight184.74 g/mol
Exact Mass184.07
IUPAC Namechloroethane;diethoxysilane
SMILESCCCl.CCO[SiH2]OCC
InChIInChI=1S/C4H12O2Si.C2H5Cl/c1-3-5-7-6-4-2;1-2-3/h3-4,7H2,1-2H3;2H2,1H3
InChIKeyHCKJKYDQMMJUFO-UHFFFAOYSA-N
XLogP1.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.74
LogP ≤ 51.30
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'}

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Related Compounds

gamma-Chloromethyl triethoxysilane
CID 87438747
3-Chloromethyltrimethoxysilane
CID 88788085
1-Chloroethoxy-diethoxy-methylsilane
CID 87125617
Bis(1-chloroethoxy)silane
CID 123183734
Tris(2-chloropropoxy)silane
CID 123451578
3-Chloropropoxy(diethoxy)silane
CID 123885341
Tris(1-chloropropoxy)silane
CID 123979185
1-Chloroethyl triethyl silicate
CID 140595669
Dibutoxy(2-chloroethoxy)silane
CID 154108793
(1-Chloro-2,2-dimethylpropoxy)-dimethoxysilane
CID 154366334
3-Chloropropoxy(propoxy)silane
CID 154510497
CID 156732892
CID 156732892

Frequently Asked Questions

What is the IUPAC name of chloroethane;diethoxysilane?
The IUPAC name of chloroethane;diethoxysilane (CID 158437501) is chloroethane;diethoxysilane.
What is the SMILES notation for chloroethane;diethoxysilane?
The canonical SMILES for chloroethane;diethoxysilane is CCCl.CCO[SiH2]OCC.
What is the InChIKey of chloroethane;diethoxysilane?
The InChIKey is HCKJKYDQMMJUFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12O2Si.C2H5Cl/c1-3-5-7-6-4-2;1-2-3/h3-4,7H2,1-2H3;2H2,1H3.
What are the key properties of chloroethane;diethoxysilane?
chloroethane;diethoxysilane has a molecular weight of 184.74 g/mol, XLogP of 1.30, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloroethane;diethoxysilane is sourced from PubChem (CID 158437501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).