4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione
4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione structure
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Common Name | 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione | ||
|---|---|---|---|---|
| CAS Number | 64198-79-4 | Molecular Weight | 244.24300 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C14H12O4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione |
|---|
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C14H12O4 |
|---|---|
| Molecular Weight | 244.24300 |
| Exact Mass | 244.07400 |
| PSA | 71.44000 |
| LogP | 2.09030 |
| InChIKey | OHVFSGGQGWQAFJ-UHFFFAOYSA-N |
| SMILES | CC(=O)CCC1=C(O)c2ccccc2C(=O)C1=O |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~98%
4-hydroxy-3-(3-... CAS#:64198-79-4 |
| Literature: Saitz, Claudio B.; Valderrama, Jaime A.; Tapia, Ricardo Synthetic Communications, 1990 , vol. 20, # 20 p. 3103 - 3114 |
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~35%
Detail
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| Literature: Peng, Da-Quan; Liu, Yun; Lu, Zhi-Feng; Shen, Yong-Miao; Xu, Jian-Hua Synthesis, 2008 , # 8 p. 1182 - 1192 |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Effect on oxygen redox cycling in Trypanosoma cruzi Tulahuen assessed as oxygen consu...
Source: ChEMBL
Target: Trypanosoma cruzi
External Id: CHEMBL921831
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Name: Effect on oxygen uptake per mg of protein in Trypanosoma cruzi Tulahuen epimastigotes...
Source: ChEMBL
Target: Trypanosoma cruzi
External Id: CHEMBL921830
|
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione? |
| A: Molecular weight of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione is 244.24300. |
| Q: What is the SMILES notation of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione? |
| A: SMILES notation of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione is CC(=O)CCC1=C(O)c2ccccc2C(=O)C1=O. |
| Q: What is the Chinese name of 64198-79-4? |
| A: Chinese name of 64198-79-4 is 64198-79-4. |
| Q: What is the molecular formula of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione? |
| A: Molecular formula of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione is C14H12O4. |
| Q: What is the polar surface area (PSA) of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione? |
| A: Polar surface area (PSA) of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione is 71.44000. |
| Q: What is the InChIKey of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione? |
| A: InChIKey of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione is OHVFSGGQGWQAFJ-UHFFFAOYSA-N. |
| Q: What is the LogP of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione? |
| A: LogP of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione is 2.09030. |
| Q: What is the CAS number of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione? |
| A: CAS number of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione is 64198-79-4. |
| Q: What is the English name of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione? |
| A: The English name of 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione is 4-hydroxy-3-(3-oxobutyl)naphthalene-1,2-dione. |