potassium 2-hydroxy-5-methylbenzoate

C8H7KO3 — CID 67847974

IUPACpotassium 2-hydroxy-5-methylbenzoate
SMILESCc1ccc(O)c(C(=O)[O-])c1.[K+]
InChIInChI=1S/C8H8O3.K/c1-5-2-3-7(9)6(4-5)8(10)11;/h2-4,9H,1H3,(H,10,11);/q;+1/p-1
InChIKeySRMWOZPVEKEMCG-UHFFFAOYSA-M
MW190.24 g/mol
LogP-2.93
Rot. Bonds1

About potassium 2-hydroxy-5-methylbenzoate

potassium 2-hydroxy-5-methylbenzoate (PubChem CID 67847974) has the molecular formula C8H7KO3 and a molecular weight of 190.24 g/mol. Its IUPAC name is potassium 2-hydroxy-5-methylbenzoate.

Molecular Properties

Compound Namepotassium 2-hydroxy-5-methylbenzoate
PubChem CID67847974
Molecular FormulaC8H7KO3
Molecular Weight190.24 g/mol
Exact Mass190.00
IUPAC Namepotassium 2-hydroxy-5-methylbenzoate
SMILESCc1ccc(O)c(C(=O)[O-])c1.[K+]
InChIInChI=1S/C8H8O3.K/c1-5-2-3-7(9)6(4-5)8(10)11;/h2-4,9H,1H3,(H,10,11);/q;+1/p-1
InChIKeySRMWOZPVEKEMCG-UHFFFAOYSA-M
XLogP-2.93
TPSA60.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.24
LogP ≤ 5-2.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

dipotassium;4-methylphthalate
CID 140576906
aluminum tris(2,5-dimethylbenzoate)
CID 22604903
sodium 4-(2-hydroxy-5-methylphenyl)-4-oxobutanoate
CID 110193908
lithium 2,5-dihydroxybenzoate
CID 55251260
dipotassium;5-[(3-carboxylato-4-hydroxyphenyl)methyl]-2-hydroxybenzoate
CID 22945073
1-(2-hydroxy-5-methylphenyl)butan-1-one
CID 4119461
1-(2-hydroxy-5-methylphenyl)-2-(methylamino)ethanone
CID 82600157
2-hydroxy-5-methyl-N-(3-methylbutan-2-yl)benzamide
CID 43084907
2-chloro-1-(2-hydroxy-5-methylphenyl)-3-methylbutan-1-one
CID 121002762
4-methyl-2-propan-2-ylbenzoate
CID 23454400
(E)-4-(2-hydroxy-5-methylphenyl)-4-oxobut-2-enenitrile
CID 155671839
(Z)-3-(dimethylamino)-1-(2-hydroxy-5-methylphenyl)prop-2-en-1-one
CID 98338444

Frequently Asked Questions

What is the IUPAC name of potassium 2-hydroxy-5-methylbenzoate?
The IUPAC name of potassium 2-hydroxy-5-methylbenzoate (CID 67847974) is potassium 2-hydroxy-5-methylbenzoate.
What is the SMILES notation for potassium 2-hydroxy-5-methylbenzoate?
The canonical SMILES for potassium 2-hydroxy-5-methylbenzoate is Cc1ccc(O)c(C(=O)[O-])c1.[K+].
What is the InChIKey of potassium 2-hydroxy-5-methylbenzoate?
The InChIKey is SRMWOZPVEKEMCG-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H8O3.K/c1-5-2-3-7(9)6(4-5)8(10)11;/h2-4,9H,1H3,(H,10,11);/q;+1/p-1.
What are the key properties of potassium 2-hydroxy-5-methylbenzoate?
potassium 2-hydroxy-5-methylbenzoate has a molecular weight of 190.24 g/mol, XLogP of -2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-hydroxy-5-methylbenzoate is sourced from PubChem (CID 67847974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).