2-nitrophenanthrene-9,10-dione
2-nitrophenanthrene-9,10-dione structure
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Common Name | 2-nitrophenanthrene-9,10-dione | ||
|---|---|---|---|---|
| CAS Number | 604-95-5 | Molecular Weight | 253.21000 | |
| Density | 1.481g/cm3 | Boiling Point | 474.3ºC at 760 mmHg | |
| Molecular Formula | C14H7NO4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 244.9ºC | |
Use of 2-nitrophenanthrene-9,10-dione2-Nitrophenanthraquinone is a bioactive compound[1]. |
Summary: 2-Nitrophenanthrene-9,10-dione (Chinese name: 2-硝基菲蒽酮-9,10-二酮, CAS number: 604-95-5), molecular formula: C14H7NO4, molecular weight: 253.21000. The boiling point is 474.3ºC at 760 mmHg, and the density is 1.481g/cm³. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-nitrophenanthrene-9,10-dione |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | 2-Nitrophenanthraquinone is a bioactive compound[1]. |
|---|---|
| Related Catalog | |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.481g/cm3 |
|---|---|
| Boiling Point | 474.3ºC at 760 mmHg |
| Molecular Formula | C14H7NO4 |
| Molecular Weight | 253.21000 |
| Flash Point | 244.9ºC |
| Exact Mass | 253.03800 |
| PSA | 79.96000 |
| LogP | 3.16400 |
| Index of Refraction | 1.688 |
| InChIKey | KNAXWOBOCVVMST-UHFFFAOYSA-N |
| SMILES | O=C1C(=O)c2cc([N+](=O)[O-])ccc2-c2ccccc21 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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2-nitrophenanth... CAS#:604-95-5 |
| Literature: Werner Justus Liebigs Annalen der Chemie, 1902 , vol. 321, p. 336 Chemische Berichte, 1904 , vol. 37, p. 3086 |
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2-nitrophenanth... CAS#:604-95-5 |
| Literature: Schmidt,J.; Heinle Chemische Berichte, 1911 , vol. 44, p. 1491,1498 |
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~%
2-nitrophenanth... CAS#:604-95-5 |
| Literature: Schmidt,J.; Heinle Chemische Berichte, 1911 , vol. 44, p. 1491,1498 |
|
~%
2-nitrophenanth... CAS#:604-95-5 |
| Literature: Werner Chemische Berichte, 1904 , vol. 37, p. 3086 Justus Liebigs Annalen der Chemie, 1902 , vol. 321, p. 336 |
|
~%
2-nitrophenanth... CAS#:604-95-5 |
| Literature: Schmidt,J.; Heinle Chemische Berichte, 1911 , vol. 44, p. 1491,1498 |
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~%
2-nitrophenanth... CAS#:604-95-5
Detail
Learn More
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| Literature: Schmidt,J.; Austin Chemische Berichte, 1903 , vol. 36, p. 3731 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
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| DownStream 5 | |
CAS#:7463-76-5
CAS#:7463-77-6
CAS#:91693-19-5
CAS#:4088-81-7This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Binding affinity to S100A4 (unknown origin) assessed as inhibition of S100A4/myosin-2...
Source: ChEMBL
Target: Protein S100-A4
External Id: CHEMBL4418534
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Name: Induction of cell death in human MDA-MB-231 cells at 10 uM incubated for 24 hrs by MT...
Source: ChEMBL
Target: MDA-MB-231
External Id: CHEMBL4418537
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Name: Inactivation of CD45
Source: ChEMBL
Target: Receptor-type tyrosine-protein phosphatase C
External Id: CHEMBL1032437
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Name: Determination of Dissociation Constant (Kd) from Article 10.1021/jm800571m: "Structur...
Source: BindingDB
Target: N/A
External Id: BindingDB_2863_1
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Name: Antiviral activity determined as inhibition of SARS-CoV-2 induced cytotoxicity of VER...
Source: ChEMBL
Target: Severe acute respiratory syndrome coronavirus 2
External Id: CHEMBL4513082
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Name: In vitro inhibition of human T-cell proliferation
Source: ChEMBL
Target: T-cell
External Id: CHEMBL812183
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Name: Inhibition of human intestinal carboxylesterase
Source: ChEMBL
Target: N/A
External Id: CHEMBL900097
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Name: ASTRAZENECA: Octan-1-ol/water (pH7.4) distribution coefficent measured by a shake fl...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3301363
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Name: Inhibition of human carboxylesterase 1
Source: ChEMBL
Target: Liver carboxylesterase 1
External Id: CHEMBL900098
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Name: Cytotoxicity measured against human T-cells
Source: ChEMBL
Target: T-cell
External Id: CHEMBL812180
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-nitro-phenanthraquinone |
| 9,2-nitro |
| 2-nitrophenanthrenequinone |
| 2-Nitro-phenanthrene-9,10-dione |
| 2-nitrophenanthrene-9,10-quinone |
| 2-nitro-9,10-phenanthrenequinone |
| C14H7O2(2-NO2) |
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-nitrophenanthrene-9,10-dione? |
| A: Polar surface area (PSA) of 2-nitrophenanthrene-9,10-dione is 79.96000. |
| Q: What is the molecular formula of 2-nitrophenanthrene-9,10-dione? |
| A: Molecular formula of 2-nitrophenanthrene-9,10-dione is C14H7NO4. |
| Q: What are the downstream products of 2-nitrophenanthrene-9,10-dione? |
| A: Related downstream products(CAS) of 2-nitrophenanthrene-9,10-dione: 7463-76-5;7463-77-6;91693-19-5;604-94-4;4088-81-7. |
| Q: What are the uses of 2-nitrophenanthrene-9,10-dione? |
| A: Main uses of 2-nitrophenanthrene-9,10-dione: 2-Nitrophenanthraquinone is a bioactive compound[1]. |
| Q: What is the CAS number of 2-nitrophenanthrene-9,10-dione? |
| A: CAS number of 2-nitrophenanthrene-9,10-dione is 604-95-5. |
| Q: What English synonyms does 2-nitrophenanthrene-9,10-dione have? |
| A: English synonyms of 2-nitrophenanthrene-9,10-dione: 2-nitro-phenanthraquinone, 9,2-nitro, 2-nitrophenanthrenequinone, 2-Nitro-phenanthrene-9,10-dione, 2-nitrophenanthrene-9,10-quinone, 2-nitro-9,10-phenanthrenequinone, C14H7O2(2-NO2). |
| Q: What is the English name of 2-nitrophenanthrene-9,10-dione? |
| A: The English name of 2-nitrophenanthrene-9,10-dione is 2-nitrophenanthrene-9,10-dione. |
| Q: What is the InChIKey of 2-nitrophenanthrene-9,10-dione? |
| A: InChIKey of 2-nitrophenanthrene-9,10-dione is KNAXWOBOCVVMST-UHFFFAOYSA-N. |
| Q: What are the upstream materials of 2-nitrophenanthrene-9,10-dione? |
| A: Related upstream materials(CAS) of 2-nitrophenanthrene-9,10-dione: 84-11-7;17024-18-9;85-01-8;7697-37-2;64-19-7. |
| Q: What is the LogP of 2-nitrophenanthrene-9,10-dione? |
| A: LogP of 2-nitrophenanthrene-9,10-dione is 3.16400. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |