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Home/Compounds/Research Reagent/Deuterated benzene
C6H6
84.15 g/mol
Research ReagentDanger

Perdeuterobenzene

CAS1076-43-3EC214-061-8
Category
Research Reagent
Compound Class
Aromatic
Primary Use
Research Compound

Perdeuterobenzene is a deuterated form of benzene in which all hydrogen atoms are replaced by deuterium. It is primarily used as a solvent and reference standard in NMR spectroscopy due to its non-interfering deuterium signal and high isotopic purity.

NMR solvent and reference standardResearch reagent for spectroscopic analysis

Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.

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Related Compounds

ReferenceSame Category

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ReferenceSame Category

(²H₅)Benzoic acid

CAS1079-02-3

research compound

Referencestereoisomer of

(benzene)ruthenium dichloride dimer

CAS37366-09-9

research compound

Referencestereoisomer of

Benzene

CAS71-43-2

solvent and chemical intermediate

Safety Reference

Flammable
Flammable
Harmful
Harmful
Health Hazard
Health Hazard
Danger
H225Highly flammable liquid and vapour
H304May be fatal if swallowed and enters airways
H315Causes skin irritation
H319Causes serious eye irritation
H340May cause genetic defects
H350May cause cancer
H372Causes damage to organs through prolonged or repeated exposure

Customs Tariff Classification

The international HS code for Perdeuterobenzene (CAS 1076-43-3) is 2845.90.

HS code (international, 6-digit)

2845.90

EU CN code (8-digit)

2845 90 10

Classification per the EU customs inventory ECICS (2026-07 snapshot, HS 2022). National tariff lines and product form can affect the final classification.

Identifiers
IUPAC Name

1,2,3,4,5,6-hexadeuteriobenzene

InChIKey

UHOVQNZJYSORNB-MZWXYZOWSA-N

SMILES

[2H]C1=C(C(=C(C(=C1[2H])[2H])[2H])[2H])[2H]

Synonyms (27)
  • D001
  • D040
  • (2H6)Benzene
  • Benzene(d6)
  • Benzene-1,2,3,4,5,6-d6
  • Benzene-D6 >99% (+0.03% TMS)
  • Benzene-d6 (Reagent grade)
  • Benzene-d6, 99 atom % D
  • Benzene-d6, 99.6 atom % D
  • D6-Benzene
  • Deuterated benzene
  • Hexadeuterobenzene
  • Perdeuterobenzene
  • Phenyl hydrided6
  • hexadeuteriobenzene

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