5-Nitro-o-Toluidinium Chloride
[CAS# 51085-52-0]

Identification

• Name: 5-Nitro-o-Toluidinium Chloride
• Synonyms: 2-Methyl-5-Nitro-Aniline Hydrochloride; (2-Methyl-5-Nitro-Phenyl)Amine Hydrochloride; 2-Methyl-5-Nitrobenzenamine, Hydrochloride
• Molecular Formula: C₇H₉ClN₂O₂
• Molecular Weight: 188.61
• CAS Registry Number: 51085-52-0
• EINECS: 256-960-8
• SMILES: [H+].C1=C(C(=CC(=C1)[N+]([O-])=O)N)C.[Cl-]
• InChI: 1S/C7H8N2O2.ClH/c1-5-2-3-6(9(10)11)4-7(5)8;/h2-4H,8H2,1H3;1H
• InChIKey: YTODVWJSAZXJHG-UHFFFAOYSA-N

Properties

• Boiling point: 329.4°C at 760 mmHg (Cal.)
• Flash point: 153°C (Cal.)

References

• (1): Sijia Xue, An Chai, Zhijuan Cai, Yongge Wei, Changsheng Xiang, Wangdong Bian and Jian Shen. A new class of functionalized polyoxometalates: synthesis, structure and preliminary antitumor activity studies of three arylimido substituted hexamolybdates bearing a strong electron-withdrawing nitro group, (BuN)[MoO(NAr)] (Ar = 3-NO-CH, 2-CH-4-NO-CH, 2-CH-5-NO-CH), Dalton Trans., 2008, 4770.