2-[4-(Methylamino)-3-nitrobenzoyl]benzoic acid

Base Information

• Chemical Name: 2-[4-(Methylamino)-3-nitrobenzoyl]benzoic acid
• CAS No.: 289913-88-8
• Molecular Formula: C15H12N2O5
• Molecular Weight: 300.27
• NSC Number: 156744
• DSSTox Substance ID: DTXSID101247610
• ChEMBL ID: CHEMBL1481453
• Mol file: 289913-88-8.mol

Synonyms:2-[4-(methylamino)-3-nitrobenzoyl]benzoic acid;289913-88-8;CHEMBL1481453;2-(4-(Methylamino)-3-nitrobenzoyl)benzoic acid;NSC-156744;NSC156744;MLS001002432;SCHEMBL7376176;DTXSID101247610;HMS2689M03;BDBM50388543;MFCD05273652;AKOS027449111;AS-9567;SMR000368959;CS-0221647;EN300-09677;2-(4-(Methylamino)-3-nitrobenzoyl)benzoicacid;o-(4-Methylamino-3-nitrobenzoyl)-benzoic acid;2-[4-(methylamino)-3-nitro-benzoyl]benzoic acid;SR-01000052713;SR-01000052713-1;Z56983156

Chemical Property of 2-[4-(Methylamino)-3-nitrobenzoyl]benzoic acid

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 300.07462149
• Heavy Atom Count: 22
• Complexity: 448

Purity/Quality:

2-[4-(Methylamino)-3-nitrobenzoyl]benzoic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CNC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)[N+](=O)[O-]