2,6-difluoro-3-hydroxybenzenesulfonamide

C6H5F2NO3S — CID 119008908

IUPAC2,6-difluoro-3-hydroxybenzenesulfonamide
SMILESNS(=O)(=O)c1c(F)ccc(O)c1F
InChIInChI=1S/C6H5F2NO3S/c7-3-1-2-4(10)5(8)6(3)13(9,11)12/h1-2,10H,(H2,9,11,12)
InChIKeyOFGUJWGEXZSPEL-UHFFFAOYSA-N
MW209.17 g/mol
LogP0.32
Rot. Bonds1

About 2,6-difluoro-3-hydroxybenzenesulfonamide

2,6-difluoro-3-hydroxybenzenesulfonamide (PubChem CID 119008908) has the molecular formula C6H5F2NO3S and a molecular weight of 209.17 g/mol. Its IUPAC name is 2,6-difluoro-3-hydroxybenzenesulfonamide.

Molecular Properties

Compound Name2,6-difluoro-3-hydroxybenzenesulfonamide
PubChem CID119008908
Molecular FormulaC6H5F2NO3S
Molecular Weight209.17 g/mol
Exact Mass209.00
IUPAC Name2,6-difluoro-3-hydroxybenzenesulfonamide
SMILESNS(=O)(=O)c1c(F)ccc(O)c1F
InChIInChI=1S/C6H5F2NO3S/c7-3-1-2-4(10)5(8)6(3)13(9,11)12/h1-2,10H,(H2,9,11,12)
InChIKeyOFGUJWGEXZSPEL-UHFFFAOYSA-N
XLogP0.32
TPSA80.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.17
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-3-hydroxybenzenesulfonamide?
The IUPAC name of 2,6-difluoro-3-hydroxybenzenesulfonamide (CID 119008908) is 2,6-difluoro-3-hydroxybenzenesulfonamide.
What is the SMILES notation for 2,6-difluoro-3-hydroxybenzenesulfonamide?
The canonical SMILES for 2,6-difluoro-3-hydroxybenzenesulfonamide is NS(=O)(=O)c1c(F)ccc(O)c1F.
What is the InChIKey of 2,6-difluoro-3-hydroxybenzenesulfonamide?
The InChIKey is OFGUJWGEXZSPEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F2NO3S/c7-3-1-2-4(10)5(8)6(3)13(9,11)12/h1-2,10H,(H2,9,11,12).
What are the key properties of 2,6-difluoro-3-hydroxybenzenesulfonamide?
2,6-difluoro-3-hydroxybenzenesulfonamide has a molecular weight of 209.17 g/mol, XLogP of 0.32, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-3-hydroxybenzenesulfonamide is sourced from PubChem (CID 119008908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).