2-Acetamido-5-bromoisonicotinic acid

Base Information

• Chemical Name: 2-Acetamido-5-bromoisonicotinic acid
• CAS No.: 871269-03-3
• Molecular Formula: C8H7BrN2O3
• Molecular Weight: 259.06
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID70428414
• Wikidata: Q82241245
• Mol file: 871269-03-3.mol

Synonyms:2-Acetamido-5-bromoisonicotinic acid;871269-03-3;2-acetamido-5-bromopyridine-4-carboxylic acid;5-bromo-2-acetamidopyridine-4-carboxylic acid;DTXSID70428414;MFCD07363802;AKOS015837734;AB30801;BS-24093;CS-0084735;FT-0653020;D74554;2-acetamido-5-bromoisonicotinic acid, AldrichCPR;EN300-7388217;A841977

Chemical Property of 2-Acetamido-5-bromoisonicotinic acid

Chemical Property:

• Vapor Pressure: 7.98E-14mmHg at 25°C
• Melting Point: 258-262 °C
• Refractive Index: 1.658
• Boiling Point: 569.9 °C at 760 mmHg
• Flash Point: 298.4 °C
• PSA: 79.29000
• Density: 1.793 g/cm³
• LogP: 1.57370
• Storage Temp.: Keep Cold
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 257.96400
• Heavy Atom Count: 14
• Complexity: 247

Purity/Quality:

97% ^*data from raw suppliers

2-Acetamido-5-bromoisonicotinicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=NC=C(C(=C1)C(=O)O)Br
• Uses: 2-Acetamido-5-bromoisonicotinic Acid is a reactant in the synthesis of nicotinic acid derivatives, used in the biological study of differentiation induced by nicotinic acid, nicotinamide and isonicotinic acid in human leukemia cell lines.