2-(2,4-dichlorophenoxy)benzenesulfonamide

C12H9Cl2NO3S — CID 2805105

IUPAC2-(2,4-dichlorophenoxy)benzenesulfonamide
SMILESNS(=O)(=O)c1ccccc1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C12H9Cl2NO3S/c13-8-5-6-10(9(14)7-8)18-11-3-1-2-4-12(11)19(15,16)17/h1-7H,(H2,15,16,17)
InChIKeyPUNZKJOQZFWYSS-UHFFFAOYSA-N
MW318.18 g/mol
LogP3.43
Rot. Bonds3

About 2-(2,4-dichlorophenoxy)benzenesulfonamide

2-(2,4-dichlorophenoxy)benzenesulfonamide (PubChem CID 2805105) has the molecular formula C12H9Cl2NO3S and a molecular weight of 318.18 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)benzenesulfonamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)benzenesulfonamide
PubChem CID2805105
Molecular FormulaC12H9Cl2NO3S
Molecular Weight318.18 g/mol
Exact Mass316.97
IUPAC Name2-(2,4-dichlorophenoxy)benzenesulfonamide
SMILESNS(=O)(=O)c1ccccc1Oc1ccc(Cl)cc1Cl
InChIInChI=1S/C12H9Cl2NO3S/c13-8-5-6-10(9(14)7-8)18-11-3-1-2-4-12(11)19(15,16)17/h1-7H,(H2,15,16,17)
InChIKeyPUNZKJOQZFWYSS-UHFFFAOYSA-N
XLogP3.43
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.18
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,4-dichlorophenoxy)benzenesulfonamide
CID 43342686
2-amino-3-(4-bromo-2-chlorophenoxy)benzenesulfonamide
CID 115993018
2-(2-chlorophenoxy)-5-nitrobenzenesulfonamide
CID 16757271
2-bromo-4-chloro-1-(2-chlorophenoxy)benzene
CID 169336335
3-chloro-4-(2-methoxyphenoxy)benzenesulfonamide
CID 61374264
5-chloro-2-(2,4-dichlorophenoxy)phenol;ethanol
CID 67724550
5-chloro-2-(2,4-dichlorophenoxy)phenol;phosphoric acid
CID 87201530
5-chloro-2-(2,4-dichlorophenoxy)phenol;phosphoric acid
CID 66601504
3-chloro-4-(2,5-difluorophenoxy)benzenesulfonamide
CID 63268736
[2-chloro-6-(2,4-dichlorophenoxy)phenyl]methanamine
CID 28966226
5-amino-2-(2-chlorophenoxy)benzenesulfonate
CID 4161171
2-(2,4-dichlorophenoxy)-5-methylsulfonylaniline
CID 43448156

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)benzenesulfonamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)benzenesulfonamide (CID 2805105) is 2-(2,4-dichlorophenoxy)benzenesulfonamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)benzenesulfonamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)benzenesulfonamide is NS(=O)(=O)c1ccccc1Oc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenoxy)benzenesulfonamide?
The InChIKey is PUNZKJOQZFWYSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2NO3S/c13-8-5-6-10(9(14)7-8)18-11-3-1-2-4-12(11)19(15,16)17/h1-7H,(H2,15,16,17).
What are the key properties of 2-(2,4-dichlorophenoxy)benzenesulfonamide?
2-(2,4-dichlorophenoxy)benzenesulfonamide has a molecular weight of 318.18 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)benzenesulfonamide is sourced from PubChem (CID 2805105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).