ethylsulfanium;zinc;dichloride

C2H7Cl2SZn- — CID 160833620

IUPACethylsulfanium;zinc;dichloride
SMILESCC[SH2+].[Cl-].[Cl-].[Zn]
InChIInChI=1S/C2H6S.2ClH.Zn/c1-2-3;;;/h3H,2H2,1H3;2*1H;/p-1
InChIKeyKUGRAIXOCOCJHH-UHFFFAOYSA-M
MW199.44 g/mol
LogP-5.98
Rot. Bonds

About ethylsulfanium;zinc;dichloride

ethylsulfanium;zinc;dichloride (PubChem CID 160833620) has the molecular formula C2H7Cl2SZn- and a molecular weight of 199.44 g/mol. Its IUPAC name is ethylsulfanium;zinc;dichloride.

Molecular Properties

Compound Nameethylsulfanium;zinc;dichloride
PubChem CID160833620
Molecular FormulaC2H7Cl2SZn-
Molecular Weight199.44 g/mol
Exact Mass196.89
IUPAC Nameethylsulfanium;zinc;dichloride
SMILESCC[SH2+].[Cl-].[Cl-].[Zn]
InChIInChI=1S/C2H6S.2ClH.Zn/c1-2-3;;;/h3H,2H2,1H3;2*1H;/p-1
InChIKeyKUGRAIXOCOCJHH-UHFFFAOYSA-M
XLogP-5.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.44
LogP ≤ 5-5.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethylsulfanium;zinc;dichloride?
The IUPAC name of ethylsulfanium;zinc;dichloride (CID 160833620) is ethylsulfanium;zinc;dichloride.
What is the SMILES notation for ethylsulfanium;zinc;dichloride?
The canonical SMILES for ethylsulfanium;zinc;dichloride is CC[SH2+].[Cl-].[Cl-].[Zn].
What is the InChIKey of ethylsulfanium;zinc;dichloride?
The InChIKey is KUGRAIXOCOCJHH-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H6S.2ClH.Zn/c1-2-3;;;/h3H,2H2,1H3;2*1H;/p-1.
What are the key properties of ethylsulfanium;zinc;dichloride?
ethylsulfanium;zinc;dichloride has a molecular weight of 199.44 g/mol, XLogP of -5.98, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethylsulfanium;zinc;dichloride is sourced from PubChem (CID 160833620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).