methylsulfinylmethane;ruthenium;dihydrochloride

C8H26Cl2O4RuS4 — CID 173203844

IUPACmethylsulfinylmethane;ruthenium;dihydrochloride
SMILESCS(C)=O.CS(C)=O.CS(C)=O.CS(C)=O.Cl.Cl.[Ru]
InChIInChI=1S/4C2H6OS.2ClH.Ru/c4*1-4(2)3;;;/h4*1-2H3;2*1H;
InChIKeyQKIVWXXUKIZNKB-UHFFFAOYSA-N
MW486.54 g/mol
LogP0.82
Rot. Bonds

About methylsulfinylmethane;ruthenium;dihydrochloride

methylsulfinylmethane;ruthenium;dihydrochloride (PubChem CID 173203844) has the molecular formula C8H26Cl2O4RuS4 and a molecular weight of 486.54 g/mol. Its IUPAC name is methylsulfinylmethane;ruthenium;dihydrochloride.

Molecular Properties

Compound Namemethylsulfinylmethane;ruthenium;dihydrochloride
PubChem CID173203844
Molecular FormulaC8H26Cl2O4RuS4
Molecular Weight486.54 g/mol
Exact Mass485.91
IUPAC Namemethylsulfinylmethane;ruthenium;dihydrochloride
SMILESCS(C)=O.CS(C)=O.CS(C)=O.CS(C)=O.Cl.Cl.[Ru]
InChIInChI=1S/4C2H6OS.2ClH.Ru/c4*1-4(2)3;;;/h4*1-2H3;2*1H;
InChIKeyQKIVWXXUKIZNKB-UHFFFAOYSA-N
XLogP0.82
TPSA68.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500486.54
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methylsulfinylmethane;ruthenium;dihydrochloride?
The IUPAC name of methylsulfinylmethane;ruthenium;dihydrochloride (CID 173203844) is methylsulfinylmethane;ruthenium;dihydrochloride.
What is the SMILES notation for methylsulfinylmethane;ruthenium;dihydrochloride?
The canonical SMILES for methylsulfinylmethane;ruthenium;dihydrochloride is CS(C)=O.CS(C)=O.CS(C)=O.CS(C)=O.Cl.Cl.[Ru].
What is the InChIKey of methylsulfinylmethane;ruthenium;dihydrochloride?
The InChIKey is QKIVWXXUKIZNKB-UHFFFAOYSA-N. The full InChI is InChI=1S/4C2H6OS.2ClH.Ru/c4*1-4(2)3;;;/h4*1-2H3;2*1H;.
What are the key properties of methylsulfinylmethane;ruthenium;dihydrochloride?
methylsulfinylmethane;ruthenium;dihydrochloride has a molecular weight of 486.54 g/mol, XLogP of 0.82, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methylsulfinylmethane;ruthenium;dihydrochloride is sourced from PubChem (CID 173203844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).