| Identification | Back Directory | [Name]
3-Amino-4-bromobenzoic acid | [CAS]
2840-29-1 | [Synonyms]
3-Amino-4-bromobenzoic acid
Benzoic acid, 3-amino-4-bromo-
3-Amino-4-bromobenzoic acid 97%
3-Amino-4-bromobenzoic Acid >
3-Amino-4-bromobenzoic acid USP/EP/BP | [Molecular Formula]
C7H6BrNO2 | [MDL Number]
MFCD00579106 | [MOL File]
2840-29-1.mol | [Molecular Weight]
216.03 |
| Chemical Properties | Back Directory | [Melting point ]
226-230 °C | [Boiling point ]
371.0±32.0 °C(Predicted) | [density ]
1.793±0.06 g/cm3(Predicted) | [storage temp. ]
Keep in dark place,Inert atmosphere,Room temperature | [form ]
powder to crystalline | [pka]
4.13±0.10(Predicted) | [color ]
White to Light yellow to Light orange | [Major Application]
peptide synthesis | [InChI]
1S/C7H6BrNO2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,9H2,(H,10,11) | [InChIKey]
TZFJADFQEBASQU-UHFFFAOYSA-N | [SMILES]
Nc1cc(ccc1Br)C(O)=O |
| Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
22-36/37/38 | [Safety Statements ]
26-36/37 | [RIDADR ]
UN 2811 6.1 / PGIII | [WGK Germany ]
3 | [HazardClass ]
6.1 | [HS Code ]
29224999 | [Storage Class]
6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects | [Hazard Classifications]
Acute Tox. 3 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Chemical Properties]
Light yellow powder | [Uses]
3-Amino-4-bromobenzoic acid is a benzoic acid derivative used in peptide synthesis. The use of 3-Amino-4-bromobenzoic acid as a raw material can be used in the preparation of Ansamitocin Libraries. | [reaction suitability]
reaction type: solution phase peptide synthesis | [Synthesis]
3-Amino-4-bromobenzoic acid can be prepared from readily available 4-bromobenzoic acid by nitration reaction with fuming nitric acid to produce 3-nitro-4-bromobenzoic acid, the key intermediate, and then by hydrogenation reaction with palladium-carbon cat |
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