Introduction：Basic information about CAS 933-37-9|Cyclohexanecarboxylic acid-d1, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Cyclohexanecarboxylic acid-d1 |
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| CAS Number | 933-37-9 | Molecular Weight | 129.17500 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C7H11DO2 | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | cyclohexanecarboxylic-1-d1 acid |
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| Synonym | More Synonyms |
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Cyclohexanecarboxylic acid-d1 BiologicalActivity
| Description | Cyclohexanecarboxylic acid-d1 is the deuterium labeled Cyclohexanecarboxylic acid[1]. Cyclohexanecarboxylic acid is a Valproate structural analogue with anticonvulsant action[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]. Liu MJ, et al. Pharmacokinetics and pharmacodynamics of valproate analogues in rats. IV. Anticonvulsant action and neurotoxicity of octanoic acid, cyclohexanecarboxylic acid, and 1-methyl-1-cyclohexanecarboxylic acid. Epilepsia. 1994 Jan-Feb;35(1):234-43. |
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Chemical & Physical Properties
| Molecular Formula | C7H11DO2 |
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| Molecular Weight | 129.17500 |
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| Exact Mass | 129.09000 |
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| PSA | 37.30000 |
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| LogP | 1.65130 |
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| InChIKey | NZNMSOFKMUBTKW-RAMDWTOOSA-N |
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| SMILES | O=C(O)C1CCCCC1 |
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Synonyms
| 1-deuterio-butane |
| 1-Deuterio-cyclohexancarbonsaeure |
| 1-deutero-4-phenoxybenzene |
| 1-deuterio-4-phenoxy-benzene |
| DIPHENYL ETHER |
| 1-Deuterio-butan |
| 1-deuteroclohexanecarboxylic acid |
| 1-Deutero-butan |
| Benzene,1,1'-oxybis |
| 1-deuterio-cyclohexanecarboxylic acid |
| Biphenyl oxide |
| 1,1'-oxydibenzene |
| Phenyl ether |
| 1-Deuterio-4-phenoxy-benzol |
