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5-Bromo-2-fluorobenzylamine hydrochloride

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Name

5-Bromo-2-fluorobenzylamine hydrochloride

EINECS N/A
CAS No. 99725-13-0 Density 1.658 g/cm3
PSA 20.23000 LogP 2.08050
Solubility N/A Melting Point 221-226 °C(lit.)
Formula C7H7BrFN.HCl Boiling Point 261.6 °C at 760 mmHg
Molecular Weight 205.026 Flash Point 112 °C
Transport Information N/A Appearance N/A
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 99725-13-0 (5-Bromo-2-fluorobenzylamine hydrochloride) Hazard Symbols IrritantXi
Synonyms

(5-Bromo-2-fluorophenyl)methanol;5-Bromo-2-fluorobenzyl alcohol;

Article Data 15

5-Bromo-2-fluorobenzylamine hydrochloride Specification

The 5-Bromo-2-fluorobenzylamine hydrochloride is an organic compound with the formula C7H7BrFN.HCl. The systematic name of this chemical is (5-bromo-2-fluorophenyl)methanol. With the CAS registry number 99725-13-0, it is also named as Benzenemethanol, 5-bromo-2-fluoro-. The product's categories are Fluorine Compounds; Anilines, Amides & Amines; Benzhydrols, Benzyl & Special Alcohols; Bromine Compounds.

Physical properties about 5-Bromo-2-fluorobenzylamine hydrochloride are: (1)ACD/LogP: 1.79; (2)ACD/LogD (pH 5.5): 1.79; (3)ACD/LogD (pH 7.4): 1.79; (4)ACD/BCF (pH 5.5): 13.56; (5)ACD/BCF (pH 7.4): 13.56; (6)ACD/KOC (pH 5.5): 225; (7)ACD/KOC (pH 7.4): 225; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 9.23 Å2; (12)Index of Refraction: 1.566; (13)Molar Refractivity: 40.38 cm3; (14)Molar Volume: 123.6 cm3; (15)Polarizability: 16.01×10-24cm3; (16)Surface Tension: 43.9 dyne/cm; (17)Density: 1.658 g/cm3; (18)Flash Point: 112 °C; (19)Enthalpy of Vaporization: 52.76 kJ/mol; (20)Boiling Point: 261.6 °C at 760 mmHg; (21)Vapour Pressure: 0.00578 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are 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: Fc1c(cc(Br)cc1)CO
(2)InChI: InChI=1/C7H6BrFO/c8-6-1-2-7(9)5(3-6)4-10/h1-3,10H,4H2
(3)InChIKey: UOSBHJFKMGLWGX-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C7H6BrFO/c8-6-1-2-7(9)5(3-6)4-10/h1-3,10H,4H2
(5)Std. InChIKey: UOSBHJFKMGLWGX-UHFFFAOYSA-N

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