5-acetamido-2-nitrobenzoic acid
5-acetamido-2-nitrobenzoic acid structure
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Common Name | 5-acetamido-2-nitrobenzoic acid | ||
|---|---|---|---|---|
| CAS Number | 4368-83-6 | Molecular Weight | 224.17000 | |
| Density | 1.526g/cm3 | Boiling Point | 522.9ºC at 760mmHg | |
| Molecular Formula | C9H8N2O5 | Melting Point | 85-89 °C(lit.) | |
| MSDS | N/A | Flash Point | 270.1ºC | |
Summary: 5-Acetylamino-2-nitrobenzoic acid (CAS: 4368-83-6), with molecular formula C9H8N2O5 and molecular weight 224.17000, is a solid in the form of light yellow to amber to dark green powder or crystals, with a melting point of 85-89 °C. 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 | 5-acetylamino-2-nitrobenzoic acid |
|---|---|
| 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 | 1.526g/cm3 |
|---|---|
| Boiling Point | 522.9ºC at 760mmHg |
| Melting Point | 85-89 °C(lit.) |
| Molecular Formula | C9H8N2O5 |
| Molecular Weight | 224.17000 |
| Flash Point | 270.1ºC |
| Exact Mass | 224.04300 |
| PSA | 112.22000 |
| LogP | 1.84760 |
| InChIKey | ZSHFMOUMOUOGKI-UHFFFAOYSA-N |
| SMILES | CC(=O)Nc1ccc([N+](=O)[O-])c(C(=O)O)c1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi:Irritant; |
|---|---|
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36 |
| HS Code | 2924299090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~95%
5-acetamido-2-n... CAS#:4368-83-6 |
| Literature: Nekhoroshev, A. A.; Sevbo, D. P.; Ginzburg, O. A. Journal of Organic Chemistry USSR (English Translation), 1981 , vol. 17, # 2 p. 313 - 317 Zhurnal Organicheskoi Khimii, 1981 , vol. 17, # 2 p. 369 - 374 |
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~%
5-acetamido-2-n... CAS#:4368-83-6 |
| Literature: Kalb et al. Chemische Berichte, 1926 , vol. 59, p. 1864 |
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~%
5-acetamido-2-n... CAS#:4368-83-6 |
| Literature: Friedlaender; Fritsch Monatshefte fuer Chemie, 1903 , vol. 24, p. 8 |
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~%
5-acetamido-2-n... CAS#:4368-83-6 |
| Literature: Friedlaender; Fritsch Monatshefte fuer Chemie, 1903 , vol. 24, p. 8 |
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~%
5-acetamido-2-n... CAS#:4368-83-6 |
| Literature: Friedlaender; Fritsch Monatshefte fuer Chemie, 1903 , vol. 24, p. 8 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 3 | |
CAS#:50670-83-2
CAS#:610-37-7
CAS#:13280-60-9This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2924299090 |
|---|---|
| Summary | 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Dicer-mediated maturation of pre-microRNA
Source: Center for Chemical Genomics, University of Michigan
Target: N/A
External Id: TargetID_659_CEMA
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Name: Inhibitors of CDC25B-CDK2/CyclinA interaction
Source: Center for Chemical Genomics, University of Michigan
External Id: MScreen:TargetID_600
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3'-Carboxy-4'-nitroacetanilide |
| MFCD00035889 |
| 5-Acetamido-2-nitrobenzoic Acid |
| EINECS 224-461-4 |
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 5-acetylamino-2-nitrobenzoic acid? |
| A: Polar surface area (PSA) of 5-acetylamino-2-nitrobenzoic acid is 112.22000. |
| Q: What is the CAS number of 5-acetylamino-2-nitrobenzoic acid? |
| A: CAS number of 5-acetylamino-2-nitrobenzoic acid is 4368-83-6. |
| Q: What is the LogP of 5-acetylamino-2-nitrobenzoic acid? |
| A: LogP of 5-acetylamino-2-nitrobenzoic acid is 1.84760. |
| Q: What is the SMILES notation of 5-acetylamino-2-nitrobenzoic acid? |
| A: SMILES notation of 5-acetylamino-2-nitrobenzoic acid is CC(=O)Nc1ccc([N+](=O)[O-])c(C(=O)O)c1. |
| Q: What is the safety information for 5-acetylamino-2-nitrobenzoic acid? |
| A: Safety information for 5-acetylamino-2-nitrobenzoic acid: S26-S36. |
| Q: What is the English name of 5-acetylamino-2-nitrobenzoic acid? |
| A: The English name of 5-acetylamino-2-nitrobenzoic acid is 5-acetylamino-2-nitrobenzoic acid. |
| Q: What English synonyms does 5-acetylamino-2-nitrobenzoic acid have? |
| A: English synonyms of 5-acetylamino-2-nitrobenzoic acid: 3'-Carboxy-4'-nitroacetanilide, MFCD00035889, 5-Acetamido-2-nitrobenzoic Acid, EINECS 224-461-4. |
| Q: What is the melting point of 5-acetylamino-2-nitrobenzoic acid? |
| A: Melting point of 5-acetylamino-2-nitrobenzoic acid is 85-89 °C(lit.). |
| Q: What is the boiling point of 5-acetylamino-2-nitrobenzoic acid? |
| A: Boiling point of 5-acetylamino-2-nitrobenzoic acid is 522.9ºC at 760mmHg. |
| Q: What is the InChIKey of 5-acetylamino-2-nitrobenzoic acid? |
| A: InChIKey of 5-acetylamino-2-nitrobenzoic acid is ZSHFMOUMOUOGKI-UHFFFAOYSA-N. |
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. |