CAS 1079-02-3

Benzoic-2,3,4,5,6-d5 acid

Description:

Benzoic-2,3,4,5,6-d5 acid, also known as deuterated benzoic acid, is a deuterated form of benzoic acid where five hydrogen atoms are replaced by deuterium, a stable isotope of hydrogen. This substitution alters the physical and chemical properties of the compound, making it useful in various applications, particularly in NMR spectroscopy, where the presence of deuterium helps in distinguishing signals and improving resolution. The compound retains the characteristic carboxylic acid functional group (-COOH), which contributes to its acidity and solubility in polar solvents. Benzoic-2,3,4,5,6-d5 acid is typically a white crystalline solid at room temperature and exhibits similar reactivity to non-deuterated benzoic acid, participating in typical acid-base reactions and forming salts with bases. Its unique isotopic composition allows for studies in reaction mechanisms and kinetics, as well as in tracing pathways in metabolic studies. The CAS number 1079-02-3 uniquely identifies this compound in chemical databases, facilitating its use in research and industrial applications.

Formula: C₇HD₅O₂

InChI: InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/i1D,2D,3D,4D,5D

InChI key: InChIKey=WPYMKLBDIGXBTP-RALIUCGRSA-N

SMILES: C(O)(=O)C1=C(C(=C(C(=C1[2H])[2H])[2H])[2H])[2H]

Synonyms:

• Benzoic-2,3,4,5,6-d5 acid
• 2,3,4,5,6-Pentadeuteriobenzoic acid
• Benzoic-d5 acid
• Benzoic acid-d5
• Pentadeuteriobenzoic acid

Benzoic acid-D5

CAS: 1079-02-3

Benzoic acid-D5

Purity: 98%

Molecular weight: 127.15g/mol

Ref: 54-DE2041

Benzoic-d5 Acid(non marqué 65-85-0)

CAS: 1079-02-3

Formula: C₆D₅COOH

Purity: 99 atom % D

Color and Shape: White Solid

Molecular weight: 127.06816

Ref: 3U-D0168

Benzoic acid D5 (phenyl D5)

Controlled Product

CAS: 1079-02-3

Formula: C₇H₅HO₂

Color and Shape: Neat

Molecular weight: 127.15

Ref: 04-C10537520

Benzoic Acid-d5

Controlled Product

CAS: 1079-02-3

Applications Benzoic Acid-d5 is a compound useful in organic synthesis. A pentadeuterated form of benzoic acid for proteomics research.
References Kurogochi, M., et al.: Molecules, 19, 9944 (2014); Liang, X., et al.: Asian J. Org. Chem., 6, 1063 (2017)

Formula: C₇₂H₅HO₂

Color and Shape: Neat

Molecular weight: 127.15

Ref: TR-B203902

BENZOIC ACID-D5

CAS: 1079-02-3

Formula: C₇H₆O₂

Purity: 90.0%

Color and Shape: Solid

Molecular weight: 127.154

Ref: 10-F468433

Benzoic- d5- acid

Controlled Product

CAS: 1079-02-3

Benzoic acid is a carboxylic acid that is found naturally in many plants, fruits and vegetables. It has been shown to be an effective inhibitor of bacterial growth by binding to the glycan moiety of peptidoglycans. Benzoic acid can be used as a calibrant for mass spectrometry. The molecular weight of benzoic acid is 100.06 g/mol and its melting point is 152 °C (309 °F). Benzoic acid has two structural isomers: ortho-benzoic acid and meta-benzoic acid. Ortho-benzoic acid has a molecular weight of 102.09 g/mol and a melting point of 145 °C (293 °F). Meta-benzoic acid has a molecular weight of 104.10 g/mol and a melting point of 155 °C (311 °F). Benzoate may also be produced from the reaction between benzoyl chloride with sodium benzo

Formula: C₇HD₅O₂

Purity: Min. 95%

Molecular weight: 127.15 g/mol

Ref: 3D-FB165025

BENZOIC ACID-D5

CAS: 1079-02-3

Formula: C₇HD₅O₂

Purity: 98%

Color and Shape: Solid

Molecular weight: 127.1521

Ref: IN-DA008RJ2