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CHLOROBENZENE-D5

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CHLOROBENZENE-D5 Basic information

Product Name:
CHLOROBENZENE-D5
Synonyms:
  • Chlorobenzene-d5, 99 atoM%D
  • Chlorobenzene-d5, Isotopic
  • 1-chloro-2,3,4,5,6-pentadeuteriobenzene
  • CHLOROBENZENE-D5, 500MG, NEAT
  • CHLOROBENZENE-D5, 1X1ML, MEOH, 2000UG/ML
  • CHLOROBENZENE-D5, 1X1ML, MEOH, 5000UG/ML
  • CHLOROBENZENE-D5 98.5 PLUS ATOM % D
  • CHLOROBENZENE-D5, 98.5 ATOM % D
CAS:
3114-55-4
MF:
C6ClD5
MW:
117.59
EINECS:
221-482-0
Product Categories:
  • Alpha Sort
  • C
  • CAlphabetic
  • CH
  • Volatiles/ Semivolatiles
Mol File:
3114-55-4.mol
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CHLOROBENZENE-D5 Chemical Properties

Boiling point:
130-130.5 °C (lit.)
Density 
1.157 g/mL at 25 °C (lit.)
refractive index 
n20/D 1.522(lit.)
Flash point:
75 °F
storage temp. 
2-8°C
solubility 
soluble in Chloroform, Ethyl Acetate
form 
Solid
color 
White
Water Solubility 
Not miscible with water.
BRN 
1866335
CAS DataBase Reference
3114-55-4(CAS DataBase Reference)
EPA Substance Registry System
Chlorobenzene-d5 (3114-55-4)
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Safety Information

Hazard Codes 
Xn,N,F,T
Risk Statements 
10-20-51/53-39/23/24/25-23/24/25-11
Safety Statements 
24/25-61-45-36/37-16-7
RIDADR 
UN 1134 3/PG 3
WGK Germany 
2
10
HazardClass 
3
PackingGroup 
III
HS Code 
28459000

MSDS

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CHLOROBENZENE-D5 Usage And Synthesis

Chemical Properties

clear colorless liquid

Uses

Chlorobenzene-d5 is a halogenated D5 chlorobenzene for proteomics research. It is a precursor to deuterated dyes and rubbers. It is used as a high-boiling solvent in industrial applications.

General Description

Chlorobenzene-d5 is a deuterated derivative of chlorobenzene having an isotopic purity of 99atom%D. 1HNMR (Proton Nuclear Magnetic Resonance) and 2HNMR (Deuterium NMR) spectra of chlorobenzene-d5 were studied in liquid crystal solvents to evaluate the quadrupolar coupling constants (DQCC) and the asymmetry parameters (η) for the deuterons. Values reported were as: DQCCortho = 180(2)kHz, ηortho = 0.06(1), DQCCmeta = 174(2)kHz, ηmeta = 0.09(3), DQCCpara= 182(4)kHz, ηPara = 0.06(4)].

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