potassium 6-hydroxynaphthalene-2-sulfonate

C10H7KO4S — CID 23677963

IUPACpotassium 6-hydroxynaphthalene-2-sulfonate
SMILESO=S(=O)([O-])c1ccc2cc(O)ccc2c1.[K+]
InChIInChI=1S/C10H8O4S.K/c11-9-3-1-8-6-10(15(12,13)14)4-2-7(8)5-9;/h1-6,11H,(H,12,13,14);/q;+1/p-1
InChIKeyPZWWSVPMGHDZNJ-UHFFFAOYSA-M
MW262.33 g/mol
LogP-1.55
Rot. Bonds1

About potassium 6-hydroxynaphthalene-2-sulfonate

potassium 6-hydroxynaphthalene-2-sulfonate (PubChem CID 23677963) has the molecular formula C10H7KO4S and a molecular weight of 262.33 g/mol. Its IUPAC name is potassium 6-hydroxynaphthalene-2-sulfonate.

Molecular Properties

Compound Namepotassium 6-hydroxynaphthalene-2-sulfonate
PubChem CID23677963
Molecular FormulaC10H7KO4S
Molecular Weight262.33 g/mol
Exact Mass261.97
IUPAC Namepotassium 6-hydroxynaphthalene-2-sulfonate
SMILESO=S(=O)([O-])c1ccc2cc(O)ccc2c1.[K+]
InChIInChI=1S/C10H8O4S.K/c11-9-3-1-8-6-10(15(12,13)14)4-2-7(8)5-9;/h1-6,11H,(H,12,13,14);/q;+1/p-1
InChIKeyPZWWSVPMGHDZNJ-UHFFFAOYSA-M
XLogP-1.55
TPSA77.43 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.33
LogP ≤ 5-1.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

sodium 7-hydroxynaphthalene-2-sulfonate
CID 23667647
6-hydroxynaphthalene-2-sulfonic acid;nickel
CID 175470147
disodium;hydride;6-hydroxynaphthalene-2-sulfonic acid
CID 173012755
4,6-dihydroxynaphthalene-2-sulfonate
CID 19096570
bis(diaminomethylideneazanium);naphthalene-2,6-disulfonate
CID 142698795
potassium 6,7-dimethylnaphthalene-2-sulfonate
CID 101323807
6,7-diiodonaphthalene-2-sulfonate
CID 177131444
lithium;sodium;bis(4-hydroxybenzenesulfonate)
CID 173430636
hexakis(ethane-1,2-diamine);bis(naphthalene-2,6-disulfonate);bis(nickel(2+));dihydrate
CID 139066976
dilithium;6-sulfinatonaphthalene-2-sulfonate;hydroxide
CID 58462977
zinc;bis(4-hydroxybenzenesulfonate);hydrate
CID 140994815
disodium;bis(4-hydroxybenzenesulfonate);dihydrate
CID 160943601

Frequently Asked Questions

What is the IUPAC name of potassium 6-hydroxynaphthalene-2-sulfonate?
The IUPAC name of potassium 6-hydroxynaphthalene-2-sulfonate (CID 23677963) is potassium 6-hydroxynaphthalene-2-sulfonate.
What is the SMILES notation for potassium 6-hydroxynaphthalene-2-sulfonate?
The canonical SMILES for potassium 6-hydroxynaphthalene-2-sulfonate is O=S(=O)([O-])c1ccc2cc(O)ccc2c1.[K+].
What is the InChIKey of potassium 6-hydroxynaphthalene-2-sulfonate?
The InChIKey is PZWWSVPMGHDZNJ-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H8O4S.K/c11-9-3-1-8-6-10(15(12,13)14)4-2-7(8)5-9;/h1-6,11H,(H,12,13,14);/q;+1/p-1.
What are the key properties of potassium 6-hydroxynaphthalene-2-sulfonate?
potassium 6-hydroxynaphthalene-2-sulfonate has a molecular weight of 262.33 g/mol, XLogP of -1.55, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 6-hydroxynaphthalene-2-sulfonate is sourced from PubChem (CID 23677963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).