Introduction：Basic information about CAS 344299-45-2|(3,4,5-Trimethoxyphenyl)acetic-2,2 Acid-d2, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | (3,4,5-Trimethoxyphenyl)acetic-2,2 Acid-d2 |
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| CAS Number | 344299-45-2 | Molecular Weight | 228.23800 |
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| Density | 1.208 g/cm3 | Boiling Point | 360.848ºC at 760 mmHg |
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| Molecular Formula | C11H12D2O5 | Melting Point | / |
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| MSDS | / | Flash Point | 138.085ºC |
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Names
| Name | 3,4,5-trimethoxyphenylacetic-2,2-d2 acid |
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BiologicalActivity
| Description | (3,4,5-Trimethoxyphenyl)acetic-2,2 Acid-d2 is the deuterium labeled 3,4,5-Trimethoxyphenylacetic acid[1]. 3,4,5-Trimethoxyphenylacetic acid is a metabolite of Mescaline[2]. |
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| Related Catalog | Research Areas >>Neurological Disease |
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| 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]. |
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| References | [1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216. [2]. Demisch L, et al. 3,4,5-Trimethoxybenzoic acid, a new mescaline metabolite in humans. Drug Metab Dispos. 1978 Sep-Oct;6(5):507-9. |
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Chemical & Physical Properties
| Density | 1.208 g/cm3 |
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| Boiling Point | 360.848ºC at 760 mmHg |
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| Molecular Formula | C11H12D2O5 |
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| Molecular Weight | 228.23800 |
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| Flash Point | 138.085ºC |
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| Exact Mass | 228.09700 |
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| PSA | 64.99000 |
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| LogP | 1.33950 |
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| InChIKey | DDSJXCGGOXKGSJ-NCYHJHSESA-N |
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| SMILES | COc1cc(CC(=O)O)cc(OC)c1OC |
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