Toluene-d8

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Names

[ CAS No. ]:
2037-26-5

[ Name ]:
Toluene-d8

[Synonym ]:
Benzene-1,2,3,4,5-d, 6-(methyl-d)-
Perdeuterated toluene
OCTADEUTEROTOLUENE
deuterated toluene
Perdeuteriotoluene
(H)Methyl(H)benzene
Toluene-d8
EINECS 218-009-5
MFCD00044638
Perdeuterotoluene
p-xylene-d10
Benzene-d5,methyl-d3

Chemical & Physical Properties

[ Density]:
0.9±0.1 g/cm3

[ Boiling Point ]:
110.6±3.0 °C at 760 mmHg

[ Melting Point ]:
-84ºC

[ Molecular Formula ]:
C7D8

[ Molecular Weight ]:
100.188

[ Flash Point ]:
4.4±0.0 °C

[ Exact Mass ]:
100.112816

[ LogP ]:
2.68

[ Vapour Pressure ]:
27.7±0.1 mmHg at 25°C

[ Index of Refraction ]:
1.500

[ Storage condition ]:
0-6°C

[ Stability ]:
Stable, but may be moisture sensitive. Highly flammable.

MSDS

Safety Information

[ Symbol ]:

GHS02, GHS07, GHS08, GHS09

[ Signal Word ]:
Danger

[ Hazard Statements ]:
H225-H304-H315-H319-H332-H336-H361d-H371-H373-H411

[ Precautionary Statements ]:
P210-P260-P280-P301 + P310-P370 + P378-P403 + P235

[ Hazard Codes ]:
F:Highlyflammable;Xn:Harmful;

[ Risk Phrases ]:
R11;R20

[ Safety Phrases ]:
S16-S25-S29-S33

[ RIDADR ]:
UN 1294 3/PG 2

[ WGK Germany ]:
1

[ Packaging Group ]:
II

[ Hazard Class ]:
3.0

Synthetic Route

Precursor & DownStream

Precursor

  • Toluene
  • 1,2-dideuterioethyne
  • Nitrogen
  • TRIISOPROPYLPHOSPHINE

DownStream

  • (2H5)Benzoyl chloride
  • deuterium hydrogen oxide
  • 4-bromotoluene-d7
  • 4-Chlorotoluene
  • 2-Chlorotoluene
  • 4-chlorotoluene-d7
  • 2-chlorotoluene-d7
  • 4-Nitrotoluene-d7
  • 1,2,3,4-tetradeuterio-5-nitro-6-(trideuteriomethyl)benzene

Articles

Position-Specific Isotope Analysis of Xanthines: A (13)C Nuclear Magnetic Resonance Method to Determine the (13)C Intramolecular Composition at Natural Abundance.

Anal. Chem. 87 , 6600-6, (2015)

The natural xanthines caffeine, theobromine, and theophylline are of major commercial importance as flavor constituents in coffee, cocoa, tea, and a number of other beverages. However, their exploitat...

The ionization mechanisms in direct and dopant-assisted atmospheric pressure photoionization and atmospheric pressure laser ionization.

J. Am. Soc. Mass Spectrom. 25(11) , 1870-81, (2014)

A novel, gas-tight API interface for gas chromatography-mass spectrometry was used to study the ionization mechanism in direct and dopant-assisted atmospheric pressure photoionization (APPI) and atmos...

Differentiation of South American crack and domestic (US) crack cocaine via headspace-gas chromatography/mass spectrometry.

Drug Test. Anal. 7(3) , 241-6, (2015)

South American 'crack' cocaine, produced directly from coca leaf, can be distinguished from US domestically produced crack on the basis of occluded solvent profiles. In addition, analysis of domestica...


More Articles


Related Compounds

  • [Ni(triisopropylphosphine)(η6-toluene-d8)]
  • toluene 2,4-diisocyanate
  • (toluene-4-sulfonylamino)-methanol
  • toluene-4-sulfonic acid-(4-chloro-2-nitro-phenyl ester)
  • Toluene, 3,5-dichloro-
  • Toluene-2,4-dicarbamicacid, bis(o-fluorophenyl) ester (8CI)