CAS 352431-26-6|(2H5)Phenyl(2H2)methyl (2H5)benzoate

Introduction:Basic information about CAS 352431-26-6|(2H5)Phenyl(2H2)methyl (2H5)benzoate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name(2H5)Phenyl(2H2)methyl (2H5)benzoate
CAS Number352431-26-6Molecular Weight224.318
Density1.1±0.1 g/cm3Boiling Point324.1±11.0 °C at 760 mmHg
Molecular FormulaC14D12O2Melting Point/
MSDS/Flash Point147.8±0.0 °C

Names

Namebenzyl benzoate-d12
SynonymMore Synonyms

(2H5)Phenyl(2H2)methyl (2H5)benzoate BiologicalActivity

DescriptionBenzyl benzoate-d12 is the deuterium labeled Benzyl benzoate[1]. Benzyl benzoate (Benzoic acid benzyl ester) is a fragrance ingredient in cosmetic products. Benzyl benzoate can be used for the research of Scabies and Demodex-associated inflammatory skin conditions[2][3][4].
Related CatalogResearch Areas >>Infection
In VitroStable 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.  

[2]. Johnson W, et, al. Safety Assessment of Benzyl Alcohol, Benzoic Acid and its Salts, and Benzyl Benzoate. Int J Toxicol. Nov/Dec 2017;36(3_suppl):5S-30S.  

[3]. Jacob S, et, al. Treatment of Demodex-associated inflammatory skin conditions: A systematic review. Dermatol Ther. 2019 Nov32(6):e13103.  

[4]. Dressler C, et, al. The Treatment of Scabies. Dtsch Arztebl Int. 2016 Nov 14113(45):757-762.  

Chemical & Physical Properties

Density1.1±0.1 g/cm3
Boiling Point324.1±11.0 °C at 760 mmHg
Molecular FormulaC14D12O2
Molecular Weight224.318
Flash Point147.8±0.0 °C
Exact Mass224.159058
PSA26.30000
LogP3.97
Vapour Pressure0.0±0.7 mmHg at 25°C
Index of Refraction1.579

Synonyms

(H)Phenyl(H)methyl (H)benzoate
Benzoic-d acid, phenyl-d-methyl-d ester
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