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201849-12-9

Basic Information
CAS No.: 201849-12-9
Name: 6-BROMO-3-CHLORO-2,4-DIFLUOROANILINE
Article Data: 2
Molecular Structure:
Molecular Structure of 201849-12-9 (6-BROMO-3-CHLORO-2,4-DIFLUOROANILINE)
Formula: C6H3BrClF2N
Molecular Weight: 242.45
Synonyms: 6-Bromo-3-chloro-2,4-difluoroaniline;6-bromo-3-chloro-2,4-difluorophenylamine;
Density: 1.89 g/cm3
Boiling Point: 251.9 °C at 760 mmHg
Flash Point: 106.2 °C
Hazard Symbols: IrritantXi
Risk Codes: 20/21/22-36/37/38
Safety: 26-36/37/39
PSA: 26.02000
LogP: 3.54410
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  • 6-BROMO-3-CHLORO-2,4-DIFLUOROANILINE  CAS NO.201849-12-9

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Specification

The CAS register number of Benzenamine, 6-bromo-3-chloro-2,4-difluoro- is 201849-12-9. It also can be called as 6-bromo-3-chloro-2,4-difluorophenylamine and the systematic name about this chemical is 6-bromo-3-chloro-2,4-difluoroaniline. The molecular formula about this chemical is C6H3BrClF2N and the molecular weight is 242.45.

Physical properties about Benzenamine, 6-bromo-3-chloro-2,4-difluoro- are: (1)ACD/LogP: 3.80; (2)ACD/LogD (pH 5.5): 3.8; (3)ACD/LogD (pH 7.4): 3.8; (4)ACD/BCF (pH 5.5): 452.5; (5)ACD/BCF (pH 7.4): 452.5; (6)ACD/KOC (pH 5.5): 2770.07; (7)ACD/KOC (pH 7.4): 2770.09; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 3.24Å2; (12)Index of Refraction: 1.586; (13)Molar Refractivity: 43.06 cm3; (14)Molar Volume: 128.2 cm3; (15)Polarizability: 17.07x10-24cm3; (16)Surface Tension: 45.8 dyne/cm; (17)Flash Point: 106.2 °C; (18)Enthalpy of Vaporization: 48.93 kJ/mol; (19)Boiling Point: 251.9 °C at 760 mmHg; (20)Vapour Pressure: 0.0199 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed. It is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing, gloves and eye/face protection. 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: Fc1c(Cl)c(F)cc(Br)c1N
(2)InChI: InChI=1/C6H3BrClF2N/c7-2-1-3(9)4(8)5(10)6(2)11/h1H,11H2
(3)InChIKey: WSZBCJHYBMSVAM-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C6H3BrClF2N/c7-2-1-3(9)4(8)5(10)6(2)11/h1H,11H2
(5)Std. InChIKey: WSZBCJHYBMSVAM-UHFFFAOYSA-N