2,4-DIAMINOFLUOROBENZENE

The 1, 3-Benzenediamine, 4-fluoro-, with the CAS registry number of 6264-67-1, is also known as 5-Amino-2-fluoroaniline and 4-Fluoro-1, 3-phenylenediamine. It belongs to the product category of Anilines, Aromatic Amines and Nitro Compounds. Its EINECS registry number is 228-426-4. This chemical's molecular formula is C₆H₇FN₂ and molecular weight is 126.13. What's more, its IUPAC name is 4-Fluorobenzene-1, 3-diamine. In addition, it should be stored in dry, cool, airtight place. And ensure there has good vantilation. Besides, it can not contact with strong oxidant, otherwise it would decompose.

Physical properties about 1, 3-Benzenediamine, 4-fluoro- are: (1)ACD/LogP: 0.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.13; (4)ACD/LogD (pH 7.4): 0.19; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 26.51; (8)ACD/KOC (pH 7.4): 30.28; (9)#H bond acceptors: 2; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 6.48 Å²; (13)Index of Refraction: 1.625; (14)Molar Refractivity: 34.71 cm³; (15)Molar Volume: 98.2 cm³; (16)Polarizability: 13.76×10^-24 cm³; (17)Surface Tension: 53.8 dyne/cm; (18)Density: 1.284 g/cm³; (19)Flash Point: 122 °C; (20)Enthalpy of Vaporization: 51.24 kJ/mol; (21)Boiling Point: 274 °C at 760 mmHg; (22)Melting Point: 34-37 °C(lit. ); (23)Vapour Pressure: 0.00553 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical may cause inflammation to the skin or other mucous membranes. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1ccc(N)cc1N
(2) InChI: InChI=1/C6H7FN2/c7-5-2-1-4(8)3-6(5)9/h1-3H,8-9H2
(3) InChIKey: QNDFYLBDUWCFJO-UHFFFAOYAB