3-Pentanol-d5
3-Pentanol-d5 structure
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Common Name | 3-Pentanol-d5 | ||
|---|---|---|---|---|
| CAS Number | 144032-75-7 | Molecular Weight | 93.17900 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C5H7D5O | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Use of 3-Pentanol-d53-Pentanol-d5 is the deuterium labeled 3-Pentanol[1]. 3-Pentanol is an active organic compound produced by plants and is a component of emitted insect sex pheromones. 3-pentanol elicits plant immunity against microbial pathogens and an insect pest in crop plants[2]. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2,2,3,4,4-pentadeuterio-pentan-3-ol |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | 3-Pentanol-d5 is the deuterium labeled 3-Pentanol[1]. 3-Pentanol is an active organic compound produced by plants and is a component of emitted insect sex pheromones. 3-pentanol elicits plant immunity against microbial pathogens and an insect pest in crop plants[2]. |
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| 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 |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C5H7D5O |
|---|---|
| Molecular Weight | 93.17900 |
| Exact Mass | 93.12020 |
| PSA | 20.23000 |
| LogP | 1.16730 |
| InChIKey | AQIXEPGDORPWBJ-WNWXXORZSA-N |
| SMILES | CCC(O)CC |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Toxicity in Tetrahymena pyriformis
Source: ChEMBL
Target: Tetrahymena pyriformis
External Id: CHEMBL3057542
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-Pentanol-2,2,3,4,4-d(5) |
| 3-Pentyl-2,2,3,4,4-d5 Alcohol |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of 2,2,3,4,4-pentadeuterio-pentan-3-ol? |
| A: Polar surface area (PSA) of 2,2,3,4,4-pentadeuterio-pentan-3-ol is 20.23000. |
| Q: What is the molecular formula of 2,2,3,4,4-pentadeuterio-pentan-3-ol? |
| A: Molecular formula of 2,2,3,4,4-pentadeuterio-pentan-3-ol is C5H7D5O. |
| Q: What are the uses of 2,2,3,4,4-pentadeuterio-pentan-3-ol? |
| A: Main uses of 2,2,3,4,4-pentadeuterio-pentan-3-ol: 3-Pentanol-d5 is the deuterium labeled 3-Pentanol[1]. 3-Pentanol is an active organic compound produced by plants and is a component of emitted insect sex pheromones. 3-pentanol elicits plant immunity against microbial pathogens and an insect pest in crop plants[2]. |
| Q: What is the CAS number of 2,2,3,4,4-pentadeuterio-pentan-3-ol? |
| A: CAS number of 2,2,3,4,4-pentadeuterio-pentan-3-ol is 144032-75-7. |
| Q: What English synonyms does 2,2,3,4,4-pentadeuterio-pentan-3-ol have? |
| A: English synonyms of 2,2,3,4,4-pentadeuterio-pentan-3-ol: 3-Pentanol-2,2,3,4,4-d(5), 3-Pentyl-2,2,3,4,4-d5 Alcohol. |
| Q: What is the InChIKey of 2,2,3,4,4-pentadeuterio-pentan-3-ol? |
| A: InChIKey of 2,2,3,4,4-pentadeuterio-pentan-3-ol is AQIXEPGDORPWBJ-WNWXXORZSA-N. |
| Q: What is the LogP of 2,2,3,4,4-pentadeuterio-pentan-3-ol? |
| A: LogP of 2,2,3,4,4-pentadeuterio-pentan-3-ol is 1.16730. |
| Q: What is the SMILES notation of 2,2,3,4,4-pentadeuterio-pentan-3-ol? |
| A: SMILES notation of 2,2,3,4,4-pentadeuterio-pentan-3-ol is CCC(O)CC. |
| Q: What is the English name of 2,2,3,4,4-pentadeuterio-pentan-3-ol? |
| A: The English name of 2,2,3,4,4-pentadeuterio-pentan-3-ol is 2,2,3,4,4-pentadeuterio-pentan-3-ol. |
| Q: What is the molecular weight of 2,2,3,4,4-pentadeuterio-pentan-3-ol? |
| A: Molecular weight of 2,2,3,4,4-pentadeuterio-pentan-3-ol is 93.17900. |