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Name	2-Bromobenzene-1,3,5-D3	EINECS	N/A
CAS No.	13122-41-3	Density	1.515 g/cm³
PSA	0.00000	LogP	2.44910
Solubility	N/A	Melting Point	N/A
Formula	C₆H₂BrD₃	Boiling Point	154.219 °C at 760 mmHg
Molecular Weight	159.986	Flash Point	51.111 °C
Transport Information	N/A	Appearance	N/A
Safety		Risk Codes	N/A
Molecular Structure		Hazard Symbols	N/A
Synonyms	Benzene-1,3,5-d3,bromo- (6CI,7CI);2,4,6-d3-Bromobenzene;	Article Data	4

2-Bromobenzene-1,3,5-D3 Specification

The cas register number of 2-Bromobenzene-1,3,5-D3 is 13122-41-3. It also can be called as Bromobenzene-2,4,6-D3 and the Systematic name about this chemical is Bromo(2,4,6-~2~H_3_)benzene.

Physical properties about 2-Bromobenzene-1,3,5-D3 are: (1)ACD/LogP: 2.94; (2)ACD/LogD (pH 5.5): 2.936; (3)ACD/LogD (pH 7.4): 2.936; (4)ACD/BCF (pH 5.5): 100.308; (5)ACD/BCF (pH 7.4): 100.308; (6)ACD/KOC (pH 5.5): 942.254; (7)ACD/KOC (pH 7.4): 942.254; (8)Index of Refraction: 1.556; (9)Molar Refractivity: 33.943 cm³; (10)Molar Volume: 105.618 cm³; (11)Polarizability: 13.456x10^-24cm³; (12)Surface Tension: 35.48 dyne/cm; (13)Enthalpy of Vaporization: 37.488 kJ/mol; (14)Vapour Pressure: 4.124 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [2H]c1cc(c(c(c1)[2H])Br)[2H]
(2)InChI: InChI=1/C6H5Br/c7-6-4-2-1-3-5-6/h1-5H/i1D,4D,5D
(3)InChIKey: QARVLSVVCXYDNA-NHPOFCFZEB
(4)Std. InChI: InChI=1S/C6H5Br/c7-6-4-2-1-3-5-6/h1-5H/i1D,4D,5D
(5)Std. InChIKey: QARVLSVVCXYDNA-NHPOFCFZSA-N

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