oxadiazole;sulfuryl dichloride

C2H2Cl2N2O3S — CID 161463546

IUPACoxadiazole;sulfuryl dichloride
SMILESO=S(=O)(Cl)Cl.c1conn1
InChIInChI=1S/C2H2N2O.Cl2O2S/c1-2-5-4-3-1;1-5(2,3)4/h1-2H;
InChIKeyWCCZYWZGSAPEGA-UHFFFAOYSA-N
MW205.02 g/mol
LogP0.78
Rot. Bonds

About oxadiazole;sulfuryl dichloride

oxadiazole;sulfuryl dichloride (PubChem CID 161463546) has the molecular formula C2H2Cl2N2O3S and a molecular weight of 205.02 g/mol. Its IUPAC name is oxadiazole;sulfuryl dichloride.

Molecular Properties

Compound Nameoxadiazole;sulfuryl dichloride
PubChem CID161463546
Molecular FormulaC2H2Cl2N2O3S
Molecular Weight205.02 g/mol
Exact Mass203.92
IUPAC Nameoxadiazole;sulfuryl dichloride
SMILESO=S(=O)(Cl)Cl.c1conn1
InChIInChI=1S/C2H2N2O.Cl2O2S/c1-2-5-4-3-1;1-5(2,3)4/h1-2H;
InChIKeyWCCZYWZGSAPEGA-UHFFFAOYSA-N
XLogP0.78
TPSA73.06 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.02
LogP ≤ 50.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of oxadiazole;sulfuryl dichloride?
The IUPAC name of oxadiazole;sulfuryl dichloride (CID 161463546) is oxadiazole;sulfuryl dichloride.
What is the SMILES notation for oxadiazole;sulfuryl dichloride?
The canonical SMILES for oxadiazole;sulfuryl dichloride is O=S(=O)(Cl)Cl.c1conn1.
What is the InChIKey of oxadiazole;sulfuryl dichloride?
The InChIKey is WCCZYWZGSAPEGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H2N2O.Cl2O2S/c1-2-5-4-3-1;1-5(2,3)4/h1-2H;.
What are the key properties of oxadiazole;sulfuryl dichloride?
oxadiazole;sulfuryl dichloride has a molecular weight of 205.02 g/mol, XLogP of 0.78, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for oxadiazole;sulfuryl dichloride is sourced from PubChem (CID 161463546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).