2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane

C8H18Cl4Si2 — CID 123506218

IUPAC2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane
SMILESClC(Cl)C[SiH2]CCCC[SiH2]CC(Cl)Cl
InChIInChI=1S/C8H18Cl4Si2/c9-7(10)5-13-3-1-2-4-14-6-8(11)12/h7-8H,1-6,13-14H2
InChIKeyCOFPOXMUUMBFEK-UHFFFAOYSA-N
MW312.22 g/mol
LogP3.38
Rot. Bonds9

About 2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane

2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane (PubChem CID 123506218) has the molecular formula C8H18Cl4Si2 and a molecular weight of 312.22 g/mol. Its IUPAC name is 2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane.

Molecular Properties

Compound Name2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane
PubChem CID123506218
Molecular FormulaC8H18Cl4Si2
Molecular Weight312.22 g/mol
Exact Mass309.97
IUPAC Name2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane
SMILESClC(Cl)C[SiH2]CCCC[SiH2]CC(Cl)Cl
InChIInChI=1S/C8H18Cl4Si2/c9-7(10)5-13-3-1-2-4-14-6-8(11)12/h7-8H,1-6,13-14H2
InChIKeyCOFPOXMUUMBFEK-UHFFFAOYSA-N
XLogP3.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.22
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

10,10-dichlorodecyl(2-methylbutyl)silane
CID 71352918
2-(2,2-dichloroethylsilyl)ethyl-trimethylsilane
CID 71389556
2-(2,2-dichloroethylsilyl)ethyl-diethylsilane
CID 175390063
10,10-dichlorodecyl(methyl)silane
CID 57370743
22,22-dichlorodocosyl(methyl)silane
CID 170842182
3,3-dichloropropyl-[2-(3,3-dichloropropylsilyl)ethyl]silane
CID 123410454
1,1-dichloro-3-methylsulfanylpropane
CID 119095673
dichloromethyl(dodecyl)silane
CID 154088389
dichloromethyl(tetradecyl)silane
CID 57351248
5,5-difluoropentyl-[4-(5,5-difluoropentylsilyl)-2-methylbutyl]silane
CID 154510794
4,4-dibutoxybutyl-[4-(4,4-dibutoxybutylsilyl)butyl]silane
CID 123229038
3-(2,2-diethoxyethylsilyl)-N-methylpropan-1-amine
CID 154465129

Frequently Asked Questions

What is the IUPAC name of 2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane?
The IUPAC name of 2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane (CID 123506218) is 2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane.
What is the SMILES notation for 2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane?
The canonical SMILES for 2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane is ClC(Cl)C[SiH2]CCCC[SiH2]CC(Cl)Cl.
What is the InChIKey of 2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane?
The InChIKey is COFPOXMUUMBFEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18Cl4Si2/c9-7(10)5-13-3-1-2-4-14-6-8(11)12/h7-8H,1-6,13-14H2.
What are the key properties of 2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane?
2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane has a molecular weight of 312.22 g/mol, XLogP of 3.38, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dichloroethyl-[4-(2,2-dichloroethylsilyl)butyl]silane is sourced from PubChem (CID 123506218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).