| Identification | Back Directory | [Name]
3-NITRO-4-METHYLOPHENYLACETIC ACID | [CAS]
54941-44-5 | [Synonyms]
4-Methyl-3-nitrophenylacetic acid 3-NITRO-4-METHYLOPHENYLACETIC ACID Benzeneacetic acid, 4-methyl-3-nitro- 4-(Carboxymethyl)-2-nitrotoluene, 5-(Carboxymethyl)-2-methylnitrobenzene 4-(Carboxymethyl)-3-nitrotoluene, 5-(Carboxymethyl)-2-methylnitrobenzene | [Molecular Formula]
C9H9NO4 | [MDL Number]
MFCD09832994 | [MOL File]
54941-44-5.mol | [Molecular Weight]
195.17 |
| Chemical Properties | Back Directory | [Boiling point ]
374.5±27.0 °C(Predicted) | [density ]
1.346±0.06 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,Room Temperature | [form ]
solid | [pka]
4.14±0.10(Predicted) | [color ]
Yellow |
| Hazard Information | Back Directory | [Synthesis]
A. Synthesis of 3-nitro-4-methylphenylacetic acid
To a dry dichloromethane solution of 4-methylphenylacetic acid (1.50 g, 10.0 mmol) was added dropwise fuming nitric acid (1.5 mL). The reaction mixture was stirred at room temperature for 2 h. The reaction was subsequently quenched with water. The reaction mixture was extracted with ethyl acetate and the organic phase was washed sequentially twice with water and once with brine. The organic layer was dried over anhydrous magnesium sulfate, filtered and concentrated under reduced pressure to give 3-nitro-4-methylphenylacetic acid (1.66 g, 85% yield). The product was characterized as follows: 1H NMR (CDCl3) δ 7.91 (d, 1H), 7.42 (dd, 1H), 7.31 (d, 1H), 3.71 (s, 2H), 2.58 (s, 3H); ES-MS m/z 196 [M + H]+. | [References]
[1] Patent: US6593322, 2003, B1 [2] Patent: WO2003/90912, 2003, A1. Location in patent: Page/Page column 117 [3] Journal fuer Praktische Chemie (Leipzig), 1891, vol. <2> 44, p. 85 [4] Patent: WO2014/145022, 2014, A1. Location in patent: Page/Page column 52 |
|
| Company Name: |
J & K SCIENTIFIC LTD.
|
| Telephone: |
18210857532 18210857532 |
| Website: |
https://www.jkchemical.com |
| Company Name: |
Henan Alfachem Co.,Ltd.
|
| Telephone: |
0371-55051623 18137891487 |
| Website: |
www.chemicalbook.com/supplier/14555231/ |
| Company Name: |
Cool Pharm, Ltd
|
| Telephone: |
021-58581007 18019463053 |
| Website: |
http://www.coolpharm.com.cn |
|