1-METHYL-4-NITRO-1H-INDOLE
1-METHYL-4-NITRO-1H-INDOLE structure
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Common Name | 1-METHYL-4-NITRO-1H-INDOLE | ||
|---|---|---|---|---|
| CAS Number | 91482-63-2 | Molecular Weight | 176.17200 | |
| Density | 1.298g/cm3 | Boiling Point | 339.247ºC at 760 mmHg | |
| Molecular Formula | C9H8N2O2 | Melting Point | 112-116 °C | |
| MSDS | N/A | Flash Point | 158.971ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 1-methyl-4-nitroindole |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.298g/cm3 |
|---|---|
| Boiling Point | 339.247ºC at 760 mmHg |
| Melting Point | 112-116 °C |
| Molecular Formula | C9H8N2O2 |
| Molecular Weight | 176.17200 |
| Flash Point | 158.971ºC |
| Exact Mass | 176.05900 |
| PSA | 50.75000 |
| LogP | 2.60970 |
| Index of Refraction | 1.631 |
| InChIKey | MGIRVUJGWSRAOV-UHFFFAOYSA-N |
| SMILES | Cn1ccc2c([N+](=O)[O-])cccc21 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2933990090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~97%
1-METHYL-4-NITR... CAS#:91482-63-2 |
| Literature: Ple, Patrick A.; Green, Tim P.; Hennequin, Laurent F.; Curwen, Jon; Fennell, Michael; Allen, Jack; Lambert-Van Der Brempt, Christine; Costello, Gerard Journal of Medicinal Chemistry, 2004 , vol. 47, # 4 p. 871 - 887 |
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~0%
1-METHYL-4-NITR... CAS#:91482-63-2 |
| Literature: Hoffmann-La Roche Inc. Patent: US6326501 B1, 2001 ; |
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~96%
1-METHYL-4-NITR... CAS#:91482-63-2 |
| Literature: Hoffmann-La Roche Inc. Patent: US6326501 B1, 2001 ; |
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~91%
1-METHYL-4-NITR... CAS#:91482-63-2 |
| Literature: Bergman, Jan; Sand, Peter Tetrahedron Letters, 1984 , vol. 25, # 18 p. 1957 - 1960 |
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~92%
1-METHYL-4-NITR... CAS#:91482-63-2 |
| Literature: Bergman, Jan; Norrby, Per-Ola; Sand, Peter Tetrahedron, 1990 , vol. 46, # 17 p. 6113 - 6124 |
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~96%
1-METHYL-4-NITR... CAS#:91482-63-2 |
| Literature: Jiang, Xinglong; Tiwari, Ashish; Thompson, Maethonia; Chen, Zhihong; Cleary, Thomas P.; Lee, Thomas B. K. Organic Process Research and Development, 2001 , vol. 5, # 6 p. 604 - 608 |
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~%
1-METHYL-4-NITR... CAS#:91482-63-2 |
| Literature: Journal of Medicinal Chemistry, , vol. 48, # 9 p. 3417 - 3427 |
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~%
1-METHYL-4-NITR... CAS#:91482-63-2 |
| Literature: Journal of Medicinal Chemistry, , vol. 48, # 9 p. 3417 - 3427 |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2933990090 |
|---|---|
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 4-nitro-N-methylindole |
| 1-methyl-4-nitro-1H-indole |
| 1H-Indole,1-methyl-4-nitro |
| 1-methyl-4-nitroindolone |
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 1-methyl-4-nitroindole? |
| A: Molecular weight of 1-methyl-4-nitroindole is 176.17200. |
| Q: What is the molecular formula of 1-methyl-4-nitroindole? |
| A: Molecular formula of 1-methyl-4-nitroindole is C9H8N2O2. |
| Q: What is the polar surface area (PSA) of 1-methyl-4-nitroindole? |
| A: Polar surface area (PSA) of 1-methyl-4-nitroindole is 50.75000. |
| Q: What is the InChIKey of 1-methyl-4-nitroindole? |
| A: InChIKey of 1-methyl-4-nitroindole is MGIRVUJGWSRAOV-UHFFFAOYSA-N. |
| Q: What is the CAS number of 1-methyl-4-nitroindole? |
| A: CAS number of 1-methyl-4-nitroindole is 91482-63-2. |
| Q: What is the boiling point of 1-methyl-4-nitroindole? |
| A: Boiling point of 1-methyl-4-nitroindole is 339.247ºC at 760 mmHg. |
| Q: What English synonyms does 1-methyl-4-nitroindole have? |
| A: English synonyms of 1-methyl-4-nitroindole: 4-nitro-N-methylindole, 1-methyl-4-nitro-1H-indole, 1H-Indole,1-methyl-4-nitro, 1-methyl-4-nitroindolone. |
| Q: What is the melting point of 1-methyl-4-nitroindole? |
| A: Melting point of 1-methyl-4-nitroindole is 112-116 °C. |
| Q: What is the English name of 1-methyl-4-nitroindole? |
| A: The English name of 1-methyl-4-nitroindole is 1-methyl-4-nitroindole. |
| Q: What is the SMILES notation of 1-methyl-4-nitroindole? |
| A: SMILES notation of 1-methyl-4-nitroindole is Cn1ccc2c([N+](=O)[O-])cccc21. |
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. |