3-Nitroaniline Hydrochloride
[CAS# 33240-96-9]

Identification

• Name: 3-Nitroaniline Hydrochloride
• Synonyms: (3-Nitrophenyl)Ammonium Chloride; 3-Nitroaniline Hydrochloride; 3-Nitroanilinium Chloride
• Molecular Formula: C₆H₇ClN₂O₂
• Molecular Weight: 174.59
• CAS Registry Number: 33240-96-9
• EINECS: 251-421-3
• SMILES: C1=CC=C(C=C1[NH3+])[N+]([O-])=O.[Cl-]
• InChI: 1S/C6H6N2O2.ClH/c7-5-2-1-3-6(4-5)8(9)10;/h1-4H,7H2;1H
• InChIKey: FWUUMDDHHPVSPL-UHFFFAOYSA-N

Properties

• Boiling point: 307°C at 760 mmHg (Cal.)
• Flash point: 139.5°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.