potassium 2-carboxyphenolate

C7H5KO3 — CID 23689489

IUPACpotassium 2-carboxyphenolate
SMILESO=C(O)c1ccccc1[O-].[K+]
InChIInChI=1S/C7H6O3.K/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H,(H,9,10);/q;+1/p-1
InChIKeyFRMWBRPWYBNAFB-UHFFFAOYSA-M
MW176.21 g/mol
LogP-2.54
Rot. Bonds1

About potassium 2-carboxyphenolate

potassium 2-carboxyphenolate (PubChem CID 23689489) has the molecular formula C7H5KO3 and a molecular weight of 176.21 g/mol. Its IUPAC name is potassium 2-carboxyphenolate.

Molecular Properties

Compound Namepotassium 2-carboxyphenolate
PubChem CID23689489
Molecular FormulaC7H5KO3
Molecular Weight176.21 g/mol
Exact Mass175.99
IUPAC Namepotassium 2-carboxyphenolate
SMILESO=C(O)c1ccccc1[O-].[K+]
InChIInChI=1S/C7H6O3.K/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H,(H,9,10);/q;+1/p-1
InChIKeyFRMWBRPWYBNAFB-UHFFFAOYSA-M
XLogP-2.54
TPSA60.36 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.21
LogP ≤ 5-2.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

copper bis(2-carboxyphenolate)
CID 54683201
2-carboxyphenolate;gold(1+)
CID 54682314
dimagnesium;tetrakis(2-carboxyphenolate)
CID 158207180
dicalcium bis(2-carboxyphenolate)
CID 158572383
magnesium tris(2-carboxyphenolate)
CID 54714197
dilithium bis(2-carboxyphenolate)
CID 54690284
triazanium;tris(2-carboxyphenolate)
CID 172802459
magnesium bis(2-carboxyphenolate)
CID 54684589
2-carboxyphenolate carbonate
CID 54676053
magnesium;bis(2-carboxyphenolate);trihydrate
CID 172729284
diazanium;bis(2-carboxyphenolate);oxovanadium
CID 173457908
2-carboxyphenolate;ethane;methane
CID 158005371

Frequently Asked Questions

What is the IUPAC name of potassium 2-carboxyphenolate?
The IUPAC name of potassium 2-carboxyphenolate (CID 23689489) is potassium 2-carboxyphenolate.
What is the SMILES notation for potassium 2-carboxyphenolate?
The canonical SMILES for potassium 2-carboxyphenolate is O=C(O)c1ccccc1[O-].[K+].
What is the InChIKey of potassium 2-carboxyphenolate?
The InChIKey is FRMWBRPWYBNAFB-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H6O3.K/c8-6-4-2-1-3-5(6)7(9)10;/h1-4,8H,(H,9,10);/q;+1/p-1.
What are the key properties of potassium 2-carboxyphenolate?
potassium 2-carboxyphenolate has a molecular weight of 176.21 g/mol, XLogP of -2.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-carboxyphenolate is sourced from PubChem (CID 23689489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).