potassium 4-hydroxybenzoate

C7H5KO3 — CID 23672310

IUPACpotassium 4-hydroxybenzoate
SMILESO=C([O-])c1ccc(O)cc1.[K+]
InChIInChI=1S/C7H6O3.K/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H,(H,9,10);/q;+1/p-1
InChIKeyDKGFIVSGQRBSOG-UHFFFAOYSA-M
MW176.21 g/mol
LogP-3.24
Rot. Bonds1

About potassium 4-hydroxybenzoate

potassium 4-hydroxybenzoate (PubChem CID 23672310) has the molecular formula C7H5KO3 and a molecular weight of 176.21 g/mol. Its IUPAC name is potassium 4-hydroxybenzoate.

Molecular Properties

Compound Namepotassium 4-hydroxybenzoate
PubChem CID23672310
Molecular FormulaC7H5KO3
Molecular Weight176.21 g/mol
Exact Mass175.99
IUPAC Namepotassium 4-hydroxybenzoate
SMILESO=C([O-])c1ccc(O)cc1.[K+]
InChIInChI=1S/C7H6O3.K/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H,(H,9,10);/q;+1/p-1
InChIKeyDKGFIVSGQRBSOG-UHFFFAOYSA-M
XLogP-3.24
TPSA60.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.21
LogP ≤ 5-3.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of potassium 4-hydroxybenzoate?
The IUPAC name of potassium 4-hydroxybenzoate (CID 23672310) is potassium 4-hydroxybenzoate.
What is the SMILES notation for potassium 4-hydroxybenzoate?
The canonical SMILES for potassium 4-hydroxybenzoate is O=C([O-])c1ccc(O)cc1.[K+].
What is the InChIKey of potassium 4-hydroxybenzoate?
The InChIKey is DKGFIVSGQRBSOG-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H6O3.K/c8-6-3-1-5(2-4-6)7(9)10;/h1-4,8H,(H,9,10);/q;+1/p-1.
What are the key properties of potassium 4-hydroxybenzoate?
potassium 4-hydroxybenzoate has a molecular weight of 176.21 g/mol, XLogP of -3.24, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 4-hydroxybenzoate is sourced from PubChem (CID 23672310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).