Introduction：Basic information about CAS 95927-02-9|Isovaleric acid-d2, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Isovaleric acid-d2 |
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| CAS Number | 95927-02-9 | Molecular Weight | 104.14400 |
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| Density | 0.982 g/cm3 | Boiling Point | 175.295ºC at 760 mmHg |
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| Molecular Formula | C5H8D2O2 | Melting Point | / |
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| MSDS | / | Flash Point | 73.402ºC |
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Names
| Name | 3-methylbutyric-2,2-d2 acid |
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Isovaleric acid-d2 BiologicalActivity
| Description | Isovaleric acid-d2 is the deuterium labeled Isovaleric acid[1]. Isovaleric acid is a natural fatty acid and known to effect on neonatal death and possible Jamaican vomiting sickness in human[2]. |
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| Related Catalog | Research Areas >>Metabolic 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]. Ackman RG, et al. Birthweights in the Faroe Islands: possible role of isovaleric acid. J Intern Med. 1989 Feb;225(2):73-5. |
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Chemical & Physical Properties
| Density | 0.982 g/cm3 |
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| Boiling Point | 175.295ºC at 760 mmHg |
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| Molecular Formula | C5H8D2O2 |
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| Molecular Weight | 104.14400 |
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| Flash Point | 73.402ºC |
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| Exact Mass | 104.08100 |
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| PSA | 37.30000 |
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| LogP | 1.11710 |
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| InChIKey | GWYFCOCPABKNJV-SMZGMGDZSA-N |
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| SMILES | CC(C)CC(=O)O |
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