potassium naphthalene-2-carboxylate

C11H7KO2 — CID 23664129

IUPACpotassium naphthalene-2-carboxylate
SMILESO=C([O-])c1ccc2ccccc2c1.[K+]
InChIInChI=1S/C11H8O2.K/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10;/h1-7H,(H,12,13);/q;+1/p-1
InChIKeyNPZDDYUXAQBRCJ-UHFFFAOYSA-M
MW210.27 g/mol
LogP-1.79
Rot. Bonds1

About potassium naphthalene-2-carboxylate

potassium naphthalene-2-carboxylate (PubChem CID 23664129) has the molecular formula C11H7KO2 and a molecular weight of 210.27 g/mol. Its IUPAC name is potassium naphthalene-2-carboxylate.

Molecular Properties

Compound Namepotassium naphthalene-2-carboxylate
PubChem CID23664129
Molecular FormulaC11H7KO2
Molecular Weight210.27 g/mol
Exact Mass210.01
IUPAC Namepotassium naphthalene-2-carboxylate
SMILESO=C([O-])c1ccc2ccccc2c1.[K+]
InChIInChI=1S/C11H8O2.K/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10;/h1-7H,(H,12,13);/q;+1/p-1
InChIKeyNPZDDYUXAQBRCJ-UHFFFAOYSA-M
XLogP-1.79
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 5-1.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of potassium naphthalene-2-carboxylate?
The IUPAC name of potassium naphthalene-2-carboxylate (CID 23664129) is potassium naphthalene-2-carboxylate.
What is the SMILES notation for potassium naphthalene-2-carboxylate?
The canonical SMILES for potassium naphthalene-2-carboxylate is O=C([O-])c1ccc2ccccc2c1.[K+].
What is the InChIKey of potassium naphthalene-2-carboxylate?
The InChIKey is NPZDDYUXAQBRCJ-UHFFFAOYSA-M. The full InChI is InChI=1S/C11H8O2.K/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10;/h1-7H,(H,12,13);/q;+1/p-1.
What are the key properties of potassium naphthalene-2-carboxylate?
potassium naphthalene-2-carboxylate has a molecular weight of 210.27 g/mol, XLogP of -1.79, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium naphthalene-2-carboxylate is sourced from PubChem (CID 23664129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).