4-[(2H3)Methyloxy]benzoic acid

Modify Date: 2024-01-10 14:15:18

4-[(2H3)Methyloxy]benzoic acid Structure
4-[(2H3)Methyloxy]benzoic acid structure
Common Name 4-[(2H3)Methyloxy]benzoic acid
CAS Number 27914-54-1 Molecular Weight 155.166
Density 1.2±0.1 g/cm3 Boiling Point 278.3±13.0 °C at 760 mmHg
Molecular Formula C8H5D3O3 Melting Point N/A
MSDS N/A Flash Point 115.5±13.3 °C

 Use of 4-[(2H3)Methyloxy]benzoic acid


4-Methoxy-benzoic acid-d3 is the deuterium labeled 4-Methoxy-benzoic acid[1].

 Names

Name 4-methoxy-d3-benzoic acid
Synonym More Synonyms

 4-[(2H3)Methyloxy]benzoic acid Biological Activity

Description 4-Methoxy-benzoic acid-d3 is the deuterium labeled 4-Methoxy-benzoic acid[1].
Related Catalog
In Vitro Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1].
References

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216.  

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 278.3±13.0 °C at 760 mmHg
Molecular Formula C8H5D3O3
Molecular Weight 155.166
Flash Point 115.5±13.3 °C
Exact Mass 155.066177
PSA 46.53000
LogP 1.96
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.546
Storage condition 2-8°C

 Synthetic Route

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4-[(2H3)Methyloxy]benzoic acid Structure

4-[(2H3)Methylo...

CAS#:27914-54-1

Literature: Derdau, Volker; Fey, Thorsten; Atzrodt, Jens Tetrahedron, 2010 , vol. 66, # 7 p. 1472 - 1482

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4-[(2H3)Methyloxy]benzoic acid Structure

4-[(2H3)Methylo...

CAS#:27914-54-1

Literature: Gillis, Richard G.; Porter, Quentin N. Organic Mass Spectrometry, 1985 , vol. 20, # 2 p. 82 - 84

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4-[(2H3)Methyloxy]benzoic acid Structure

4-[(2H3)Methylo...

CAS#:27914-54-1

Literature: Gillis, Richard G.; Porter, Quentin N. Organic Mass Spectrometry, 1985 , vol. 20, # 2 p. 82 - 84

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4-[(2H3)Methyloxy]benzoic acid Structure

4-[(2H3)Methylo...

CAS#:27914-54-1

Literature: Derdau, Volker; Fey, Thorsten; Atzrodt, Jens Journal of Labelled Compounds and Radiopharmaceuticals, 2010 , vol. 53, # 5-6 p. 381 - 383

 Synonyms

Benzoic acid, 4-(methyl-d-oxy)-
4-trideuteriomethoxy-benzoic acid
p-methoxy-d3-benzoic acid
4-[(H)Methyloxy]benzoic acid