2-chloroethyl(dichloromethoxy)silane

C3H7Cl3OSi — CID 123769523

IUPAC2-chloroethyl(dichloromethoxy)silane
SMILESClCC[SiH2]OC(Cl)Cl
InChIInChI=1S/C3H7Cl3OSi/c4-1-2-8-7-3(5)6/h3H,1-2,8H2
InChIKeyAYBCWWLQGRRBGE-UHFFFAOYSA-N
MW193.53 g/mol
LogP1.51
Rot. Bonds4

About 2-chloroethyl(dichloromethoxy)silane

2-chloroethyl(dichloromethoxy)silane (PubChem CID 123769523) has the molecular formula C3H7Cl3OSi and a molecular weight of 193.53 g/mol. Its IUPAC name is 2-chloroethyl(dichloromethoxy)silane.

Molecular Properties

Compound Name2-chloroethyl(dichloromethoxy)silane
PubChem CID123769523
Molecular FormulaC3H7Cl3OSi
Molecular Weight193.53 g/mol
Exact Mass191.93
IUPAC Name2-chloroethyl(dichloromethoxy)silane
SMILESClCC[SiH2]OC(Cl)Cl
InChIInChI=1S/C3H7Cl3OSi/c4-1-2-8-7-3(5)6/h3H,1-2,8H2
InChIKeyAYBCWWLQGRRBGE-UHFFFAOYSA-N
XLogP1.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.53
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

3-(dichloromethoxysilyl)propanenitrile
CID 154498962
dichloromethoxy(hexyl)silane
CID 150153887
2-chloroethyl(methoxy)silane
CID 154337921
3-(1,2-dichloroethoxysilyl)propanenitrile
CID 175461131
2-chloroethyl(ethoxymethoxy)silane;dihydrochloride
CID 173434038
dichloromethoxy(phenyl)silane
CID 154085065
bis(1,1-dichloroethane);bis(1,2-dichloroethane)
CID 175329145
1,2,4-trichloro-1-methoxybutane
CID 19787421
cyclobutyl(dichloromethoxy)silane
CID 154407787
2-chloroethyl-(trimethyl-λ4-sulfanyl)silane
CID 152757302
heptan-4-yloxy(6-heptan-4-yloxysilylhexyl)silane
CID 123472134
2,6-dimethylheptan-3-yloxy-[2-(2,6-dimethylheptan-3-yloxysilyl)ethyl]silane
CID 123487885

Frequently Asked Questions

What is the IUPAC name of 2-chloroethyl(dichloromethoxy)silane?
The IUPAC name of 2-chloroethyl(dichloromethoxy)silane (CID 123769523) is 2-chloroethyl(dichloromethoxy)silane.
What is the SMILES notation for 2-chloroethyl(dichloromethoxy)silane?
The canonical SMILES for 2-chloroethyl(dichloromethoxy)silane is ClCC[SiH2]OC(Cl)Cl.
What is the InChIKey of 2-chloroethyl(dichloromethoxy)silane?
The InChIKey is AYBCWWLQGRRBGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7Cl3OSi/c4-1-2-8-7-3(5)6/h3H,1-2,8H2.
What are the key properties of 2-chloroethyl(dichloromethoxy)silane?
2-chloroethyl(dichloromethoxy)silane has a molecular weight of 193.53 g/mol, XLogP of 1.51, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloroethyl(dichloromethoxy)silane is sourced from PubChem (CID 123769523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).