2′-Nitroacetophenone
2′-Nitroacetophenone structure
|
Common Name | 2′-Nitroacetophenone | ||
|---|---|---|---|---|
| CAS Number | 577-59-3 | Molecular Weight | 165.146 | |
| Density | 1.23 | Boiling Point | 286.4±13.0 °C at 760 mmHg | |
| Molecular Formula | C8H7NO3 | Melting Point | 76-78 °C(lit.) | |
| MSDS | Chinese USA | Flash Point | 137.8±12.6 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-Nitroacetophenone |
|---|---|
| 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 | 1.23 |
|---|---|
| Boiling Point | 286.4±13.0 °C at 760 mmHg |
| Melting Point | 76-78 °C(lit.) |
| Molecular Formula | C8H7NO3 |
| Molecular Weight | 165.146 |
| Flash Point | 137.8±12.6 °C |
| Exact Mass | 165.042587 |
| PSA | 62.89000 |
| LogP | 1.28 |
| Vapour Pressure | 0.0±0.6 mmHg at 25°C |
| Index of Refraction | 1.558 |
| InChIKey | SUGXZLKUDLDTKX-UHFFFAOYSA-N |
| SMILES | CC(=O)c1ccccc1[N+](=O)[O-] |
| Storage condition | Refrigerator |
| Stability | Stable. Combustible. Incompatible with strong oxidizing agents. |
| Water Solubility | Insoluble |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
MUTATION DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xn:Harmful; |
| Risk Phrases | R22 |
| Safety Phrases | S22-S24/25 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| RTECS | AM9625000 |
| Packaging Group | III |
| Hazard Class | 6.1 |
| HS Code | 29147090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 7 | |
|---|---|
| DownStream 9 | |
CAS#:612-22-6![N-[1-(2-nitrophenyl)ethylidene]hydroxylamine Structure](https://image.chemsrc.com/caspic/074/10342-62-8.png)
CAS#:10342-62-8
CAS#:6213-94-1
CAS#:609-73-4
CAS#:98-86-2
CAS#:132993-22-7
CAS#:201230-82-2
CAS#:492-27-3
CAS#:551-93-9
CAS#:3205-25-2
CAS#:491-35-0
CAS#:2034-40-4
CAS#:480-93-3
CAS#:90323-06-1![2-[methyl-[1-(2-nitrophenyl)ethyl]amino]ethanol structure](https://image.chemsrc.com/caspic/055/188978-98-5.png)
CAS#:188978-98-5
CAS#:552-16-9This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2914700090 |
|---|---|
| Summary | HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 1-(2-Nitrophenyl)ethan-1-one |
| 2-Nitroacetophene |
| O-NITROACETOPHENONE |
| 1-(2-Nitrophenyl)ethanone |
| o-Acetylnitrobenzene |
| 2-Acetylnitrobenzene |
| 2`-Nitroacetophenone |
| MFCD00007259 |
| 1-(2-Nitrophenyl)-1-ethanone |
| WNR BV1 |
| EINECS 209-414-8 |
| o-Nitrophenyl methyl ketone |
| 2-nitrophenylacetoaldehyde |
| 1-Acetyl-2-nitrobenzene |
| 2′-Nitroacetophenone |
| Methyl 2-nitrophenyl ketone |
| o-Nitroacetylbenzene |
| 2'-Nitroacetophenone |
| 2'-METHYLBIPHENYL-2-CARBOXYLIC ACID |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the SMILES notation of 2-Nitroacetophenone? |
| A: SMILES notation of 2-Nitroacetophenone is CC(=O)c1ccccc1[N+](=O)[O-]. |
| Q: How is the water solubility of 2-Nitroacetophenone? |
| A: Water solubility of 2-Nitroacetophenone: Insoluble. |
| Q: What is the boiling point of 2-Nitroacetophenone? |
| A: Boiling point of 2-Nitroacetophenone is 286.4±13.0 °C at 760 mmHg. |
| Q: What are the storage conditions for 2-Nitroacetophenone? |
| A: Storage conditions for 2-Nitroacetophenone: Refrigerator. |
| Q: What English synonyms does 2-Nitroacetophenone have? |
| A: English synonyms of 2-Nitroacetophenone: 1-(2-Nitrophenyl)ethan-1-one, 2-Nitroacetophene, O-NITROACETOPHENONE, 1-(2-Nitrophenyl)ethanone, o-Acetylnitrobenzene, 2-Acetylnitrobenzene, 2`-Nitroacetophenone, MFCD00007259, 1-(2-Nitrophenyl)-1-ethanone, WNR BV1, EINECS 209-414-8, o-Nitrophenyl methyl ketone, 2-nitrophenylacetoaldehyde, 1-Acetyl-2-nitrobenzene, 2′-Nitroacetophenone, Methyl 2-nitrophenyl ketone, o-Nitroacetylbenzene, 2'-Nitroacetophenone, 2'-METHYLBIPHENYL-2-CARBOXYLIC ACID. |
| Q: What is the melting point of 2-Nitroacetophenone? |
| A: Melting point of 2-Nitroacetophenone is 76-78 °C(lit.). |
| Q: What is the safety information for 2-Nitroacetophenone? |
| A: Safety information for 2-Nitroacetophenone: S22-S24/25. |
| Q: What are the upstream materials of 2-Nitroacetophenone? |
| A: Related upstream materials(CAS) of 2-Nitroacetophenone: 612-22-6;10342-62-8;6213-94-1;609-73-4;98-86-2;132993-22-7;201230-82-2. |
| Q: What are the downstream products of 2-Nitroacetophenone? |
| A: Related downstream products(CAS) of 2-Nitroacetophenone: 492-27-3;551-93-9;3205-25-2;491-35-0;2034-40-4;480-93-3;90323-06-1;188978-98-5;552-16-9. |
| Q: What is the InChIKey of 2-Nitroacetophenone? |
| A: InChIKey of 2-Nitroacetophenone is SUGXZLKUDLDTKX-UHFFFAOYSA-N. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Huangshi Healthday Pharmaceutical Technology Co., Ltd. |
| Dayang Chem (Hangzhou) Co., Ltd. |
| Henan Tianfu Chemical Co., Ltd. |