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About This Item
Linear Formula:
C6D5Br
CAS Number:
Molecular Weight:
162.04
EC Number:
224-013-8
UNSPSC Code:
12142201
PubChem Substance ID:
Beilstein/REAXYS Number:
1866602
MDL number:
Isotopic purity:
≥99 atom % D
Assay:
≥99% (CP)
Mass shift:
M+5
Form:
liquid
grade
reagent grade
isotopic purity
≥99 atom % D
assay
≥99% (CP)
form
liquid
refractive index
n20/D 1.5585 (lit.)
bp
156 °C, 53 °C/23 mmHg (lit.)
density
1.538 g/mL at 25 °C, 1.539 g/mL at 25 °C (lit.)
application(s)
electronics
pharmaceutical
mass shift
M+5
SMILES string
[2H]c1c([2H])c([2H])c(Br)c([2H])c1[2H]
InChI
1S/C6H5Br/c7-6-4-2-1-3-5-6/h1-5H/i1D,2D,3D,4D,5D
InChI key
QARVLSVVCXYDNA-RALIUCGRSA-N
Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.
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signalword
Warning
hcodes
Hazard Classifications
Aquatic Chronic 2 - Flam. Liq. 3 - Skin Irrit. 2
Storage Class
3 - Flammable liquids
wgk
WGK 3
flash_point_f
123.8 °F - closed cup
flash_point_c
51 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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Optical constants, and vibrational assignment of liquid bromobenzene-d5 between 4000 and 400cm-1 at 25? C.
Keefe CD and Donovan LA.
Journal of Molecular Structure, 597(1), 259-268 (2001)
Calixarenes. 5. Dynamic NMR characteristics of p-tert-butylcalix [4]-arene and p-tert-butylcalix [8] arene.
Gutsche CD and Bauer LJ.
Tetrahedron Letters, 22(48), 4763-4766 (1981)


