2-Bromo-3-fluoroaniline supplier

Name
2-Bromo-3-fluoroaniline
EINECS
CAS No. 111721-75-6
Article Data7
CAS DataBase
Density 1.695 g/cm³
Solubility Slightly soluble in water.
Melting Point 32-34 °C
Formula C₆H₅BrFN
Boiling Point 229.845 °C at 760 mmHg
Molecular Weight 190.015
Flash Point 92.807 °C
Transport Information
Appearance
Safety 9-26-36/37-60
Risk Codes Xi:Harmful/Irritant;
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Bromo-3-fluorophenylamine;
PSA 26.02000
LogP 2.75160

2-Bromo-3-fluoroaniline Specification

The 2-Bromo-3-fluoroaniline is an organic compound with the formula C₆H₅BrFN. The IUPAC name of this chemical is 2-bromo-3-fluoroaniline. With the CAS registry number 111721-75-6, it is also named as Benzenamine, 2-bromo-3-fluoro-. The product's categories are Anilines, Aromatic Amines and Nitro Compounds; Aniline.

Physical properties about 2-Bromo-3-fluoroaniline are: (1)ACD/LogP: 2.12; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 52; (5)ACD/BCF (pH 7.4): 52; (6)ACD/KOC (pH 5.5): 586; (7)ACD/KOC (pH 7.4): 586; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 26.02 Å²; (12)Index of Refraction: 1.597; (13)Molar Refractivity: 38.173 cm³; (14)Molar Volume: 112.108 cm³; (15)Polarizability: 15.133×10^-24cm³; (16)Surface Tension: 45.227 dyne/cm; (17)Density: 1.695 g/cm³; (18)Flash Point: 92.807 °C; (19)Enthalpy of Vaporization: 46.647 kJ/mol; (20)Boiling Point: 229.845 °C at 760 mmHg; (21)Vapour Pressure: 0.068 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Fc1cccc(N)c1Br
(2)InChI: InChI=1/C6H5BrFN/c7-6-4(8)2-1-3-5(6)9/h1-3H,9H2
(3)InChIKey: XZRSXRUYZXBTGD-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C6H5BrFN/c7-6-4(8)2-1-3-5(6)9/h1-3H,9H2
(5)Std. InChIKey: XZRSXRUYZXBTGD-UHFFFAOYSA-N

Product Name

2-Bromo-3-fluoroaniline

2-Bromo-3-fluoroaniline Specification

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