| Identification | More | [Name]
4-Bromoisophthalic acid | [CAS]
6939-93-1 | [Synonyms]
2-BROMOBENZENE-1,5-DICARBOXYLIC ACID
4-BROMO-1,3-BENZENEDICARBOXYLIC ACID
4-BROMOISOPHTHALIC ACID
TIMTEC-BB SBB003189
4-bromo-3-benzenedicarboxylicacid
4-Bromobenzene-1,3-dicarboxylic acid
1,3-Benzenedicarboxylic acid, 4-bromo-
4-Bromoisophthalic acid 97%
1,3-Dicarboxy-4-bromobenzene | [EINECS(EC#)]
230-078-3 | [Molecular Formula]
C8H5BrO4 | [MDL Number]
MFCD00002404 | [Molecular Weight]
245.03 | [MOL File]
6939-93-1.mol |
| Chemical Properties | Back Directory | [Appearance]
white to off-white crystalline powder and chunks | [Melting point ]
297-299 °C(lit.)
| [Boiling point ]
430.6±40.0 °C(Predicted) | [density ]
1.8281 (rough estimate) | [refractive index ]
1.4490 (estimate) | [storage temp. ]
Store at room temperature | [solubility ]
soluble in Methanol | [form ]
Crystalline Powder and Chunks | [pka]
2.48±0.10(Predicted) | [color ]
White to off-white | [BRN ]
1959392 | [InChI]
1S/C8H5BrO4/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3H,(H,10,11)(H,12,13) | [InChIKey]
MSQIEZXCNYUWHN-UHFFFAOYSA-N | [SMILES]
OC(=O)c1ccc(Br)c(c1)C(O)=O | [CAS DataBase Reference]
6939-93-1(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . | [WGK Germany ]
3
| [HS Code ]
29173990 | [Storage Class]
13 - Non Combustible Solids |
| Hazard Information | Back Directory | [Chemical Properties]
white to off-white crystalline powder and chunks | [Uses]
4-Bromoisophthalic Acid is an inhibitor of glutamate decarboxylase. | [Synthesis]
A mixture of 4-bromo-m-xylene (25.3 g, 137 mmol), KMnO4 (100 g, 633 mmol) and water (1.5 L) was heated at reflux for 16 hours.
The mixture was cooled to room temperature and diafiltered. The filtrate was extracted by adding 6 M HCl aqueous solution (100 |
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