dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene

C10H14Cl2OPtS — CID 134900367

IUPACdichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene
SMILESC=C.Cc1ccc(S(C)=O)cc1.Cl[Pt]Cl
InChIInChI=1S/C8H10OS.C2H4.2ClH.Pt/c1-7-3-5-8(6-4-7)10(2)9;1-2;;;/h3-6H,1-2H3;1-2H2;2*1H;/q;;;;+2/p-2
InChIKeyCBSLYWYCWRJGFT-UHFFFAOYSA-L
MW448.27 g/mol
LogP3.91
Rot. Bonds1

About dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene

dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene (PubChem CID 134900367) has the molecular formula C10H14Cl2OPtS and a molecular weight of 448.27 g/mol. Its IUPAC name is dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene.

Molecular Properties

Compound Namedichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene
PubChem CID134900367
Molecular FormulaC10H14Cl2OPtS
Molecular Weight448.27 g/mol
Exact Mass446.98
IUPAC Namedichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene
SMILESC=C.Cc1ccc(S(C)=O)cc1.Cl[Pt]Cl
InChIInChI=1S/C8H10OS.C2H4.2ClH.Pt/c1-7-3-5-8(6-4-7)10(2)9;1-2;;;/h3-6H,1-2H3;1-2H2;2*1H;/q;;;;+2/p-2
InChIKeyCBSLYWYCWRJGFT-UHFFFAOYSA-L
XLogP3.91
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.27
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene?
The IUPAC name of dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene (CID 134900367) is dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene.
What is the SMILES notation for dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene?
The canonical SMILES for dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene is C=C.Cc1ccc(S(C)=O)cc1.Cl[Pt]Cl.
What is the InChIKey of dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene?
The InChIKey is CBSLYWYCWRJGFT-UHFFFAOYSA-L. The full InChI is InChI=1S/C8H10OS.C2H4.2ClH.Pt/c1-7-3-5-8(6-4-7)10(2)9;1-2;;;/h3-6H,1-2H3;1-2H2;2*1H;/q;;;;+2/p-2.
What are the key properties of dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene?
dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene has a molecular weight of 448.27 g/mol, XLogP of 3.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloroplatinum;ethene;1-methyl-4-methylsulfinylbenzene is sourced from PubChem (CID 134900367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).