chloro hypochlorite;3,5-dichloropyridine;selane

C5H5Cl4NOSe — CID 174537044

IUPACchloro hypochlorite;3,5-dichloropyridine;selane
SMILESClOCl.Clc1cncc(Cl)c1.[SeH2]
InChIInChI=1S/C5H3Cl2N.Cl2O.H2Se/c6-4-1-5(7)3-8-2-4;1-3-2;/h1-3H;;1H2
InChIKeyKKQHYXDAWHLOIO-UHFFFAOYSA-N
MW315.87 g/mol
LogP2.78
Rot. Bonds

About chloro hypochlorite;3,5-dichloropyridine;selane

chloro hypochlorite;3,5-dichloropyridine;selane (PubChem CID 174537044) has the molecular formula C5H5Cl4NOSe and a molecular weight of 315.87 g/mol. Its IUPAC name is chloro hypochlorite;3,5-dichloropyridine;selane.

Molecular Properties

Compound Namechloro hypochlorite;3,5-dichloropyridine;selane
PubChem CID174537044
Molecular FormulaC5H5Cl4NOSe
Molecular Weight315.87 g/mol
Exact Mass314.83
IUPAC Namechloro hypochlorite;3,5-dichloropyridine;selane
SMILESClOCl.Clc1cncc(Cl)c1.[SeH2]
InChIInChI=1S/C5H3Cl2N.Cl2O.H2Se/c6-4-1-5(7)3-8-2-4;1-3-2;/h1-3H;;1H2
InChIKeyKKQHYXDAWHLOIO-UHFFFAOYSA-N
XLogP2.78
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.87
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro hypochlorite;3,5-dichloropyridine;selane?
The IUPAC name of chloro hypochlorite;3,5-dichloropyridine;selane (CID 174537044) is chloro hypochlorite;3,5-dichloropyridine;selane.
What is the SMILES notation for chloro hypochlorite;3,5-dichloropyridine;selane?
The canonical SMILES for chloro hypochlorite;3,5-dichloropyridine;selane is ClOCl.Clc1cncc(Cl)c1.[SeH2].
What is the InChIKey of chloro hypochlorite;3,5-dichloropyridine;selane?
The InChIKey is KKQHYXDAWHLOIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H3Cl2N.Cl2O.H2Se/c6-4-1-5(7)3-8-2-4;1-3-2;/h1-3H;;1H2.
What are the key properties of chloro hypochlorite;3,5-dichloropyridine;selane?
chloro hypochlorite;3,5-dichloropyridine;selane has a molecular weight of 315.87 g/mol, XLogP of 2.78, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro hypochlorite;3,5-dichloropyridine;selane is sourced from PubChem (CID 174537044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).