(2-nitrophenyl) selenohypochlorite

C6H4ClNO2Se — CID 71359588

IUPAC(2-nitrophenyl) selenohypochlorite
SMILESO=[N+]([O-])c1ccccc1[Se]Cl
InChIInChI=1S/C6H4ClNO2Se/c7-11-6-4-2-1-3-5(6)8(9)10/h1-4H
InChIKeySNVGOAPIUATWTL-UHFFFAOYSA-N
MW236.52 g/mol
LogP1.08
Rot. Bonds2

About (2-nitrophenyl) selenohypochlorite

(2-nitrophenyl) selenohypochlorite (PubChem CID 71359588) has the molecular formula C6H4ClNO2Se and a molecular weight of 236.52 g/mol. Its IUPAC name is (2-nitrophenyl) selenohypochlorite.

Molecular Properties

Compound Name(2-nitrophenyl) selenohypochlorite
PubChem CID71359588
Molecular FormulaC6H4ClNO2Se
Molecular Weight236.52 g/mol
Exact Mass236.91
IUPAC Name(2-nitrophenyl) selenohypochlorite
SMILESO=[N+]([O-])c1ccccc1[Se]Cl
InChIInChI=1S/C6H4ClNO2Se/c7-11-6-4-2-1-3-5(6)8(9)10/h1-4H
InChIKeySNVGOAPIUATWTL-UHFFFAOYSA-N
XLogP1.08
TPSA43.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.52
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-hydroxyselanyl-2-nitrobenzene
CID 15565401
N-methyl-N-(2-nitrophenyl)selanylmethanamine
CID 14947914
(2-nitrophenyl)selanyl cyanate
CID 11379526
azanide;1,2-dinitrobenzene;platinum
CID 158959684
1-bromo-2-nitrobenzene
CID 158366116
1-benzylsulfanylselanyl-2-nitrobenzene
CID 101025159
1-nitro-2-(2-nitropropan-2-yl)benzene
CID 87409221
1-bromo-2-nitrobenzene;ethane
CID 91072043
2-[(2,6-dinitrophenyl)diselanyl]-1,3-dinitrobenzene
CID 88784383
N,N-dichloro-2-nitroaniline
CID 13272655
1-chloro-2-nitrobenzene;methanol
CID 157371441
(2-nitrophenyl)methanol
CID 11923

Frequently Asked Questions

What is the IUPAC name of (2-nitrophenyl) selenohypochlorite?
The IUPAC name of (2-nitrophenyl) selenohypochlorite (CID 71359588) is (2-nitrophenyl) selenohypochlorite.
What is the SMILES notation for (2-nitrophenyl) selenohypochlorite?
The canonical SMILES for (2-nitrophenyl) selenohypochlorite is O=[N+]([O-])c1ccccc1[Se]Cl.
What is the InChIKey of (2-nitrophenyl) selenohypochlorite?
The InChIKey is SNVGOAPIUATWTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4ClNO2Se/c7-11-6-4-2-1-3-5(6)8(9)10/h1-4H.
What are the key properties of (2-nitrophenyl) selenohypochlorite?
(2-nitrophenyl) selenohypochlorite has a molecular weight of 236.52 g/mol, XLogP of 1.08, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-nitrophenyl) selenohypochlorite is sourced from PubChem (CID 71359588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).