2-Iodo-4-nitroaniline

The 2-Iodo-4-nitroaniline, with the CAS registry number 6293-83-0, is also known as benzenamine, 2-iodo-4-nitro-. It belongs to the product categories of Anilines, Aromatic Amines and Nitro Compounds; Amines; C2 to C6; Nitrogen Compounds. This chemical's molecular formula is C₆H₅IN₂O₂ and molecular weight is 264.02. What's more, its IUPAC name is the same with its product name. It should be stored in a cool, dry and well-ventilated place.

Physical properties about 2-Iodo-4-nitroaniline are: (1)ACD/LogP: 2.632 ; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.63; (4)ACD/LogD (pH 7.4): 2.63; (5)ACD/BCF (pH 5.5): 58.98; (6)ACD/BCF (pH 7.4): 58.98; (7)ACD/KOC (pH 5.5): 644.29; (8)ACD/KOC (pH 7.4): 644.29; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 71.84 Å²; (13)Index of Refraction: 1.726; (14)Molar Refractivity: 49.941 cm³; (15)Molar Volume: 125.628 cm³; (16)Polarizability: 19.798×10^-24cm³; (17)Surface Tension: 70.634 dyne/cm; (18)Density: 2.102 g/cm³; (19)Flash Point: 182.146 °C; (20)Enthalpy of Vaporization: 62.535 kJ/mol; (21)Boiling Point: 377.566 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin, eyes and respiratory system or other mucous membranes. Therefore, you should wear suitable protective clothing. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: Ic1cc([N+]([O-])=O)ccc1N
(2) InChI: InChI=1S/C6H5IN2O2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H,8H2
(3) InChIKey: LOLSEMNGXKAZBZ-UHFFFAOYSA-N