chloroselenonylbenzene

C6H5ClO2Se — CID 140969306

IUPACchloroselenonylbenzene
SMILESO=[Se](=O)(Cl)c1ccccc1
InChIInChI=1S/C6H5ClO2Se/c7-10(8,9)6-4-2-1-3-5-6/h1-5H
InChIKeyISSRNKWZFQZREN-UHFFFAOYSA-N
MW223.52 g/mol
LogP0.93
Rot. Bonds1

About chloroselenonylbenzene

chloroselenonylbenzene (PubChem CID 140969306) has the molecular formula C6H5ClO2Se and a molecular weight of 223.52 g/mol. Its IUPAC name is chloroselenonylbenzene.

Molecular Properties

Compound Namechloroselenonylbenzene
PubChem CID140969306
Molecular FormulaC6H5ClO2Se
Molecular Weight223.52 g/mol
Exact Mass223.91
IUPAC Namechloroselenonylbenzene
SMILESO=[Se](=O)(Cl)c1ccccc1
InChIInChI=1S/C6H5ClO2Se/c7-10(8,9)6-4-2-1-3-5-6/h1-5H
InChIKeyISSRNKWZFQZREN-UHFFFAOYSA-N
XLogP0.93
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.52
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

chloroselenonylbenzene;hydrofluoride
CID 174953141
1-[dichloro(phenyl)-λ4-selanyl]pyrrolidine-2,5-dione
CID 12550110
phenylseleninyl benzeneselenonate
CID 141046145
1,2-diphenylethane-1,2-dione bromide
CID 86754555
[difluoro(phenyl)-lambda4-selanyl]benzene
CID 12529933
benzoic acid;zirconium
CID 173089080
1-[2-[dichloro(phenyl)-λ4-selanyl]phenyl]ethanone
CID 11110755
potassium;chlorobenzene;hydride
CID 173115077
bis(1,2-diphenylethane-1,2-dione);hydrogen peroxide
CID 18415505
benzoyl chloride;selane
CID 174449470
benzoyl fluoride;tetrahydrofluoride
CID 139728839
tetrakis(carbonochloridic acid);diphenylmethanone
CID 173240243

Frequently Asked Questions

What is the IUPAC name of chloroselenonylbenzene?
The IUPAC name of chloroselenonylbenzene (CID 140969306) is chloroselenonylbenzene.
What is the SMILES notation for chloroselenonylbenzene?
The canonical SMILES for chloroselenonylbenzene is O=[Se](=O)(Cl)c1ccccc1.
What is the InChIKey of chloroselenonylbenzene?
The InChIKey is ISSRNKWZFQZREN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5ClO2Se/c7-10(8,9)6-4-2-1-3-5-6/h1-5H.
What are the key properties of chloroselenonylbenzene?
chloroselenonylbenzene has a molecular weight of 223.52 g/mol, XLogP of 0.93, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloroselenonylbenzene is sourced from PubChem (CID 140969306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).