chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane

C6H16Cl2S2 — CID 130316792

IUPACchloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane
SMILESCS(C)(Cl)CCS(C)(C)Cl
InChIInChI=1S/C6H16Cl2S2/c1-9(2,7)5-6-10(3,4)8/h5-6H2,1-4H3
InChIKeyLJFBATTVXXUIDC-UHFFFAOYSA-N
MW223.23 g/mol
LogP3.42
Rot. Bonds3

About chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane

chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane (PubChem CID 130316792) has the molecular formula C6H16Cl2S2 and a molecular weight of 223.23 g/mol. Its IUPAC name is chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane.

Molecular Properties

Compound Namechloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane
PubChem CID130316792
Molecular FormulaC6H16Cl2S2
Molecular Weight223.23 g/mol
Exact Mass222.01
IUPAC Namechloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane
SMILESCS(C)(Cl)CCS(C)(C)Cl
InChIInChI=1S/C6H16Cl2S2/c1-9(2,7)5-6-10(3,4)8/h5-6H2,1-4H3
InChIKeyLJFBATTVXXUIDC-UHFFFAOYSA-N
XLogP3.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane?
The IUPAC name of chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane (CID 130316792) is chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane.
What is the SMILES notation for chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane?
The canonical SMILES for chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane is CS(C)(Cl)CCS(C)(C)Cl.
What is the InChIKey of chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane?
The InChIKey is LJFBATTVXXUIDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16Cl2S2/c1-9(2,7)5-6-10(3,4)8/h5-6H2,1-4H3.
What are the key properties of chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane?
chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane has a molecular weight of 223.23 g/mol, XLogP of 3.42, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-[2-[chloro(dimethyl)-λ4-sulfanyl]ethyl]-dimethyl-λ4-sulfane is sourced from PubChem (CID 130316792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).