potassium;sulfuryl dichloride;nitrate

Cl2KNO5S — CID 172693068

IUPACpotassium;sulfuryl dichloride;nitrate
SMILESO=S(=O)(Cl)Cl.O=[N+]([O-])[O-].[K+]
InChIInChI=1S/Cl2O2S.K.NO3/c1-5(2,3)4;;2-1(3)4/q;+1;-1
InChIKeyBYEAHVSISMTLNH-UHFFFAOYSA-N
MW236.07 g/mol
LogP-2.53
Rot. Bonds

About potassium;sulfuryl dichloride;nitrate

potassium;sulfuryl dichloride;nitrate (PubChem CID 172693068) has the molecular formula Cl2KNO5S and a molecular weight of 236.07 g/mol. Its IUPAC name is potassium;sulfuryl dichloride;nitrate.

Molecular Properties

Compound Namepotassium;sulfuryl dichloride;nitrate
PubChem CID172693068
Molecular FormulaCl2KNO5S
Molecular Weight236.07 g/mol
Exact Mass234.85
IUPAC Namepotassium;sulfuryl dichloride;nitrate
SMILESO=S(=O)(Cl)Cl.O=[N+]([O-])[O-].[K+]
InChIInChI=1S/Cl2O2S.K.NO3/c1-5(2,3)4;;2-1(3)4/q;+1;-1
InChIKeyBYEAHVSISMTLNH-UHFFFAOYSA-N
XLogP-2.53
TPSA100.34 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.07
LogP ≤ 5-2.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of potassium;sulfuryl dichloride;nitrate?
The IUPAC name of potassium;sulfuryl dichloride;nitrate (CID 172693068) is potassium;sulfuryl dichloride;nitrate.
What is the SMILES notation for potassium;sulfuryl dichloride;nitrate?
The canonical SMILES for potassium;sulfuryl dichloride;nitrate is O=S(=O)(Cl)Cl.O=[N+]([O-])[O-].[K+].
What is the InChIKey of potassium;sulfuryl dichloride;nitrate?
The InChIKey is BYEAHVSISMTLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/Cl2O2S.K.NO3/c1-5(2,3)4;;2-1(3)4/q;+1;-1.
What are the key properties of potassium;sulfuryl dichloride;nitrate?
potassium;sulfuryl dichloride;nitrate has a molecular weight of 236.07 g/mol, XLogP of -2.53, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;sulfuryl dichloride;nitrate is sourced from PubChem (CID 172693068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).