5-(3-Chloro-4-methylphenyl)nicotinic acid

Base Information

• Chemical Name: 5-(3-Chloro-4-methylphenyl)nicotinic acid
• CAS No.: 1261934-19-3
• Molecular Formula: C13H10ClNO2
• Molecular Weight: 247.677
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID00687618
• Wikidata: Q82614343
• Mol file: 1261934-19-3.mol

Synonyms:5-(3-CHLORO-4-METHYLPHENYL)NICOTINIC ACID;1261934-19-3;5-(3-chloro-4-methylphenyl)pyridine-3-carboxylic acid;DTXSID00687618;MFCD18317590;AKOS017552365;BS-20253;5-(3-CHLORO-4-METHYLPHENYL)NICOTINICACID

Chemical Property of 5-(3-Chloro-4-methylphenyl)nicotinic acid

Chemical Property:

• PSA: 50.19000
• LogP: 3.40860
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 247.0400063
• Heavy Atom Count: 17
• Complexity: 285

Purity/Quality:

5-(3-Chloro-4-methylphenyl)nicotinicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)C2=CC(=CN=C2)C(=O)O)Cl