formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol

C13H12O5S — CID 6452549

IUPACformaldehyde;2-(2-hydroxyphenyl)sulfonylphenol
SMILESC=O.O=S(=O)(c1ccccc1O)c1ccccc1O
InChIInChI=1S/C12H10O4S.CH2O/c13-9-5-1-3-7-11(9)17(15,16)12-8-4-2-6-10(12)14;1-2/h1-8,13-14H;1H2
InChIKeyIMLMEIUTKRNUPD-UHFFFAOYSA-N
MW280.30 g/mol
LogP1.75
Rot. Bonds2

About formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol

formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol (PubChem CID 6452549) has the molecular formula C13H12O5S and a molecular weight of 280.30 g/mol. Its IUPAC name is formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol.

Molecular Properties

Compound Nameformaldehyde;2-(2-hydroxyphenyl)sulfonylphenol
PubChem CID6452549
Molecular FormulaC13H12O5S
Molecular Weight280.30 g/mol
Exact Mass280.04
IUPAC Nameformaldehyde;2-(2-hydroxyphenyl)sulfonylphenol
SMILESC=O.O=S(=O)(c1ccccc1O)c1ccccc1O
InChIInChI=1S/C12H10O4S.CH2O/c13-9-5-1-3-7-11(9)17(15,16)12-8-4-2-6-10(12)14;1-2/h1-8,13-14H;1H2
InChIKeyIMLMEIUTKRNUPD-UHFFFAOYSA-N
XLogP1.75
TPSA91.67 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.30
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol?
The IUPAC name of formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol (CID 6452549) is formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol.
What is the SMILES notation for formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol?
The canonical SMILES for formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol is C=O.O=S(=O)(c1ccccc1O)c1ccccc1O.
What is the InChIKey of formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol?
The InChIKey is IMLMEIUTKRNUPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O4S.CH2O/c13-9-5-1-3-7-11(9)17(15,16)12-8-4-2-6-10(12)14;1-2/h1-8,13-14H;1H2.
What are the key properties of formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol?
formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol has a molecular weight of 280.30 g/mol, XLogP of 1.75, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol is sourced from PubChem (CID 6452549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).