Introduction：Basic information about 3-NITROPHENYLACETIC ACID CAS 1877-73-2, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
3-NITROPHENYLACETIC ACID Basic information
| Product Name: | 3-NITROPHENYLACETIC ACID |
| Synonyms: | RARECHEM AL BO 0446;(M-NITROPHENYL)ACETIC ACID;(m-nitrophenyl)-aceticaci;3-Nitrobenzeneacetic acid;3-nitro-benzeneaceticaci;3-nitrobenzeneaceticacid;3-Nitrophenylessigsαure;Benzeneacetic acid, 3-nitro- |
| CAS: | 1877-73-2 |
| MF: | C8H7NO4 |
| MW: | 181.15 |
| EINECS: | 217-512-7 |
| Product Categories: | Aromatic Phenylacetic Acids and Derivatives;Aromatics Compounds;Aromatics;C8;Carbonyl Compounds;Carboxylic Acids |
| Mol File: | 1877-73-2.mol |
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3-NITROPHENYLACETIC ACID Chemical Properties
| Melting point | 117-120 °C (lit.) |
| Boiling point | 314.24°C (rough estimate) |
| density | 1.4283 (rough estimate) |
| refractive index | 1.5468 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | Chloroform (Slightly, Heated), Methanol (Slightly), DMSO (Slightly) |
| form | Crystalline Powder |
| pka | 3.97(at 25℃) |
| color | Cream |
| Water Solubility | Soluble in water. |
| BRN | 2050088 |
| InChI | 1S/C8H7NO4/c10-8(11)5-6-2-1-3-7(4-6)9(12)13/h1-4H,5H2,(H,10,11) |
| InChIKey | WUKHOVCMWXMOOA-UHFFFAOYSA-N |
| SMILES | OC(=O)Cc1cccc(c1)[N+]([O-])=O |
| CAS DataBase Reference | 1877-73-2(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| RTECS | AJ1129900 |
| HS Code | 29163990 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
3-NITROPHENYLACETIC ACID Usage And Synthesis
| Chemical Properties | Pale Orange Solid |
| Uses | 3-Nitrophenylacetic acid is a useful synthetic intermediate. |
| Uses | 3-Nitrophenylacetic acid, is a useful synthetic intermediate. |
| General Description | 3-Nitrophenylacetic acid is obtained by mild oxidation of 4-amino phenylacetic acid using potassium peroxymonosulfate as oxidizing agent in acetone. |
3-NITROPHENYLACETIC ACID Preparation Products And Raw materials
| Raw materials | Tetrahydrofuran-->Magnesium-->Carbon dioxide-->3-Nitrobenzyl bromide |
| Preparation Products | 3-(3-AMINOPHENYL)-2H-CHROMEN-2-ONE-->1-(2-Bromoethyl)-3-nitrobenzene-->Methyl 3-nitrophenylacetate-->3-Aminophenylacetic acid-->2-(3-aminophenyl)-N,N-dimethylacetamide(SALTDATA: FREE) |
