BENZENE-D6

BENZENE-D6
  • CAS No.:1076-43-3
Other grades of this product :
BENZENE-D6 Basic information
Product Name:BENZENE-D6
Synonyms:(2H6)benzene;D6-Benzene;hexadeuterio-benzene;Hexadeuterobenzol;Perdeuteratedbenzene;Perdeuterobenzene;Benzene-d6, with 0.03% TMS, 99.6 atom% D;BenzeneD6>99.6%(+0.03%tms)
CAS:1076-43-3
MF:C6D6
MW:84.15
EINECS:214-061-8
Product Categories:Analytical Chemistry;Deuterated Compounds for NMR;NMR Spectrometry;600 Series Wastewater Methods;EPA;Method 624;Benzene-d6;Aldrich High Purity NMR Solvents for Routine NMR;Alphabetical Listings;B;High Throughput NMR;Labware;NMR;NMR Solvents;NMR Solvents and Reagents;Routine NMR;Solvent by Application;Solvents;Solvents for High Throughput NMR;Spectroscopy Solvents (IR;Stable Isotopes;Tubes and Accessories;UV/Vis)
Mol File:1076-43-3.mol
BENZENE-D6 Chemical Properties
Melting point 6.8 °C(lit.)
Boiling point 79.1 °C(lit.)
density 0.950 g/mL at 25 °C(lit.)
vapor pressure 101 hPa (20 °C)
refractive index n20/D 1.497(lit.)
Fp 12 °F
storage temp. no restrictions.
solubility Miscible with most organic solvents.
form Liquid
Specific Gravity0.950
color Colorless
explosive limit1.4-8.0%(V)
Water Solubility Slightly Soluble in water.
Sensitive Moisture Sensitive
BRN 1905426
Exposure limitsACGIH: TWA 0.5 ppm; STEL 2.5 ppm (Skin)OSHA: Ceiling 25 ppm; TWA 10 ppm; TWA 1 ppm; STEL 5 ppmNIOSH: IDLH 500 ppm; TWA 0.1 ppm; STEL 1 ppm
Stability:Stable. Incompatible with oxidizing agents, acids, bases, halogens, metal salts. Protect from moisture. Highly flammable.
InChIKeyUHOVQNZJYSORNB-MZWXYZOWSA-N
CAS DataBase Reference1076-43-3(CAS DataBase Reference)
EPA Substance Registry SystemBenzene-d6 (1076-43-3)
Safety Information
Hazard Codes F,T
Risk Statements 45-46-11-36/38-48/23/24/25-65-39/23/24/25-23/24/25-48/23/24
Safety Statements 53-45-36/37
RIDADR UN 1114 3/PG 2
WGK Germany 3
10-21
Autoignition Temperature555 °C
TSCA Yes
HazardClass 3
PackingGroup II
HS Code 29022000
ToxicityLD50 orally in Rabbit: 930 mg/kg LD50 dermal Rabbit > 8260 mg/kg
MSDS Information
ProviderLanguage
SigmaAldrich English
ALFA English
BENZENE-D6 Usage And Synthesis
Chemical PropertiesBENZENE-D6 is colourless liquid
UsesIsotope labelled benzene, an organic compound that is a natural constituent of crude oil and one of the most basic petrochemicals.
UsesBENZENE-D6 is a common solvent used in NMR spectroscopy.
UsesBenzene-d6 is a solvent used in nuclear magnetic resonance spectroscopy (NMR).
General DescriptionBenzene-d6 (C6D6) is deuterated benzene. Its Soret coefficient S(T) has been measured by transient holographic grating technique. Its synthesis,13C NMR, IR and MS spectra have been reported.
Purification MethodsHexadeuteriobenzene of 99.5% purity is refluxed over and distilled from CaH2 onto Linde type 5A sieves under N2. [Beilstein 5 III 518, 5 IV 630.]

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