175730

Bromobenzene-d₅

99.5 atom % D

• Synonym(s): Pentadeuterobromobenzene
• Linear Formula: C₆D₅Br
• CAS Number: 4165-57-5
• Molecular Weight: 162.04
• Beilstein: 1866602
• EC Number: 224-013-8
• MDL number: MFCD00000056
• UNSPSC Code: 12142201
• PubChem Substance ID: 24850526
• NACRES: NA.21

Properties

• isotopic purity: 99.5 atom % D
• Assay: 99% (CP)
• form: liquid
• technique(s): NMR: suitable
• refractive index: n20/D 1.5585 (lit.)
• bp: 156 °C; 53 °C/23 mmHg (lit.)
• density: 1.539 g/mL at 25 °C (lit.)
• 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

Description

General description

Bromobenzene-d₅ is a deuterated derivative of bromobenzene having an isotopic purity of 99.5 atom% D. Temperature dependent ¹H-NMR (Proton Nuclear Magnetic Resonance) spectra of calixarenes (p-tert-butylcalix-[4]- and calix[8]arene) have been investigated in CDCl₃ and bromobenzene-d₅. Imaginary refractive indices, real refractive indices and other absorption quantities and imaginary molar polarizability spectra of liquid bromobenzene-d₅ have been evaluated.

Application

Bromobenzene-d₅ may be used in the preparation of orthoterphenyl-d₁₀ (OTP-d₁₀).

Starting material used to prepare free radicals for ESR studies.

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Safety Information

• Pictograms: GHS02,GHS07,GHS09
• Signal Word: Warning
• Hazard Statements: H226,H315,H411
• Precautionary Statements: P210 - P233 - P240 - P241 - P273 - P303 + P361 + P353
• Hazard Classifications: Aquatic Chronic 2 - Flam. Liq. 3 - Skin Irrit. 2
• Storage Class Code: 3 - Flammable liquids
• WGK: WGK 3
• Flash Point(F): 123.8 °F - closed cup
• Flash Point(C): 51 °C - closed cup
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves