| Identification | Back Directory | [Name]
2-(4-NITROPHENYL)BUTYRIC ACID | [CAS]
7463-53-8 | [Synonyms]
2-(p-nitrophenyl)-butyricaci
2-(p-nitrophenyl)butyricacid
A-ETHYL-4-NITROBENZONIC ACID
2-(4-NITROPHENYL)BUTYRIC ACID
2-(4-NITROPLENYL)BUTYRIC ACID
2-(p-Nitrophenyl)butanoic acid
2-(4-nitrophenyl)butanoic acid
α-(p-Nitro-phenyl)butyric acid
alpha-ethyl-4-nitro-benzeneaceticaci
alpha-ethyl-4-nitrobenzeneaceticacid
ALPHA-ETHYL-4-NITROPHENYLACETIC ACID | [EINECS(EC#)]
231-256-3 | [Molecular Formula]
C10H11NO4 | [MDL Number]
MFCD00156935 | [MOL File]
7463-53-8.mol | [Molecular Weight]
209.2 |
| Chemical Properties | Back Directory | [Melting point ]
122-123 °C | [Boiling point ]
371.2±25.0 °C(Predicted) | [density ]
1.287±0.06 g/cm3(Predicted) | [storage temp. ]
Storage temp. 2-8°C | [pka]
3.91±0.10(Predicted) | [Appearance]
White to off-white Solid | [InChI]
InChI=1S/C10H11NO4/c1-2-9(10(12)13)7-3-5-8(6-4-7)11(14)15/h3-6,9H,2H2,1H3,(H,12,13) | [InChIKey]
XBGNOMBPRQVJSR-UHFFFAOYSA-N | [SMILES]
C(O)(=O)C(C1=CC=C([N+]([O-])=O)C=C1)CC |
| Hazard Information | Back Directory | [Chemical Properties]
Crystallizes. Melting point 121-122°C. | [Uses]
2-(4-Nitrophenyl)butyric acid is a key intermediate in the synthesis of indobufen, a new generation of anti-platelet aggregation agents. | [Synthesis]
Synthesis of 2-(4-nitrophenyl)butyric acid, using α-phenylbutyronitrile as the starting material, to produce 2-(4-nitrophenyl)butyronitrile by nitration reaction, and then by hydrolysis reaction to produce 2-(4-nitrophenyl)butyric acid. |
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