methylsulfinylmethane;rhodium(3+);trichloride

C6H18Cl3O3RhS3 — CID 172999990

IUPACmethylsulfinylmethane;rhodium(3+);trichloride
SMILESCS(C)=O.CS(C)=O.CS(C)=O.[Cl-].[Cl-].[Cl-].[Rh+3]
InChIInChI=1S/3C2H6OS.3ClH.Rh/c3*1-4(2)3;;;;/h3*1-2H3;3*1H;/q;;;;;;+3/p-3
InChIKeyXMMNCSJGPIAVPA-UHFFFAOYSA-K
MW443.67 g/mol
LogP-9.01
Rot. Bonds

About methylsulfinylmethane;rhodium(3+);trichloride

methylsulfinylmethane;rhodium(3+);trichloride (PubChem CID 172999990) has the molecular formula C6H18Cl3O3RhS3 and a molecular weight of 443.67 g/mol. Its IUPAC name is methylsulfinylmethane;rhodium(3+);trichloride.

Molecular Properties

Compound Namemethylsulfinylmethane;rhodium(3+);trichloride
PubChem CID172999990
Molecular FormulaC6H18Cl3O3RhS3
Molecular Weight443.67 g/mol
Exact Mass441.85
IUPAC Namemethylsulfinylmethane;rhodium(3+);trichloride
SMILESCS(C)=O.CS(C)=O.CS(C)=O.[Cl-].[Cl-].[Cl-].[Rh+3]
InChIInChI=1S/3C2H6OS.3ClH.Rh/c3*1-4(2)3;;;;/h3*1-2H3;3*1H;/q;;;;;;+3/p-3
InChIKeyXMMNCSJGPIAVPA-UHFFFAOYSA-K
XLogP-9.01
TPSA51.21 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.67
LogP ≤ 5-9.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methylsulfinylmethane;rhodium(3+);trichloride?
The IUPAC name of methylsulfinylmethane;rhodium(3+);trichloride (CID 172999990) is methylsulfinylmethane;rhodium(3+);trichloride.
What is the SMILES notation for methylsulfinylmethane;rhodium(3+);trichloride?
The canonical SMILES for methylsulfinylmethane;rhodium(3+);trichloride is CS(C)=O.CS(C)=O.CS(C)=O.[Cl-].[Cl-].[Cl-].[Rh+3].
What is the InChIKey of methylsulfinylmethane;rhodium(3+);trichloride?
The InChIKey is XMMNCSJGPIAVPA-UHFFFAOYSA-K. The full InChI is InChI=1S/3C2H6OS.3ClH.Rh/c3*1-4(2)3;;;;/h3*1-2H3;3*1H;/q;;;;;;+3/p-3.
What are the key properties of methylsulfinylmethane;rhodium(3+);trichloride?
methylsulfinylmethane;rhodium(3+);trichloride has a molecular weight of 443.67 g/mol, XLogP of -9.01, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methylsulfinylmethane;rhodium(3+);trichloride is sourced from PubChem (CID 172999990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).