potassium;5-bromopyridine-3-carbaldehyde;hydroxide

C6H5BrKNO2 — CID 172681834

IUPACpotassium;5-bromopyridine-3-carbaldehyde;hydroxide
SMILESO=Cc1cncc(Br)c1.[K+].[OH-]
InChIInChI=1S/C6H4BrNO.K.H2O/c7-6-1-5(4-9)2-8-3-6;;/h1-4H;;1H2/q;+1;/p-1
InChIKeyAMWWWMGGRMCPLH-UHFFFAOYSA-M
MW242.11 g/mol
LogP-1.52
Rot. Bonds1

About potassium;5-bromopyridine-3-carbaldehyde;hydroxide

potassium;5-bromopyridine-3-carbaldehyde;hydroxide (PubChem CID 172681834) has the molecular formula C6H5BrKNO2 and a molecular weight of 242.11 g/mol. Its IUPAC name is potassium;5-bromopyridine-3-carbaldehyde;hydroxide.

Molecular Properties

Compound Namepotassium;5-bromopyridine-3-carbaldehyde;hydroxide
PubChem CID172681834
Molecular FormulaC6H5BrKNO2
Molecular Weight242.11 g/mol
Exact Mass240.91
IUPAC Namepotassium;5-bromopyridine-3-carbaldehyde;hydroxide
SMILESO=Cc1cncc(Br)c1.[K+].[OH-]
InChIInChI=1S/C6H4BrNO.K.H2O/c7-6-1-5(4-9)2-8-3-6;;/h1-4H;;1H2/q;+1;/p-1
InChIKeyAMWWWMGGRMCPLH-UHFFFAOYSA-M
XLogP-1.52
TPSA59.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.11
LogP ≤ 5-1.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-iodopyridine-3-carbaldehyde
CID 23436817
3-bromo-5-(2,2-difluoroethenyl)pyridine
CID 169260385
3-[(amino-methyl-oxo-λ6-sulfanylidene)methyl]-5-bromopyridine
CID 123267119
5-difluoroboranylpyridine-3-carbaldehyde
CID 57416946
5-bromopyridin-3-amine;formamide
CID 175312718
4-(5-bromo-3-pyridinyl)but-3-enoic acid
CID 170484556
5-(2-bromophenyl)pyridine-3-carbaldehyde
CID 24729817
3,5-dibromobenzaldehyde;ethane
CID 145297632
5-formylpyridine-3-carbonitrile
CID 12919806
3-bromo-5-[2-(2,4,5-trifluorophenyl)ethenyl]pyridine
CID 123543896
4-(5-bromo-3-pyridinyl)but-3-ene-1-thiol
CID 170479354
5-propan-2-ylpyridine-3-carbaldehyde;hydrochloride
CID 155943309

Frequently Asked Questions

What is the IUPAC name of potassium;5-bromopyridine-3-carbaldehyde;hydroxide?
The IUPAC name of potassium;5-bromopyridine-3-carbaldehyde;hydroxide (CID 172681834) is potassium;5-bromopyridine-3-carbaldehyde;hydroxide.
What is the SMILES notation for potassium;5-bromopyridine-3-carbaldehyde;hydroxide?
The canonical SMILES for potassium;5-bromopyridine-3-carbaldehyde;hydroxide is O=Cc1cncc(Br)c1.[K+].[OH-].
What is the InChIKey of potassium;5-bromopyridine-3-carbaldehyde;hydroxide?
The InChIKey is AMWWWMGGRMCPLH-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H4BrNO.K.H2O/c7-6-1-5(4-9)2-8-3-6;;/h1-4H;;1H2/q;+1;/p-1.
What are the key properties of potassium;5-bromopyridine-3-carbaldehyde;hydroxide?
potassium;5-bromopyridine-3-carbaldehyde;hydroxide has a molecular weight of 242.11 g/mol, XLogP of -1.52, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;5-bromopyridine-3-carbaldehyde;hydroxide is sourced from PubChem (CID 172681834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).