Vitas-M small molecule compound

5-aminobenzene-1,3-dicarboxylic acid

Catalog ID
STK429341
SMILES Nc1cc(cc(c1)C(=O)O)C(=O)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C8H7NO4 MW 181.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H7NO4/c9-6-2-4(7(10)11)1-5(3-6)8(12)13/h1-3H,9H2,(H,10,11)(H,12,13)
InChIKey
KBZFDRWPMZESDI-UHFFFAOYSA-N
Synonyms
99-31-0
13BENZENEDICARBOXYLICACID5AMINO
35DICARBOXYANILINE
5AMINO13BENZENDICARBOXYLICACID
5AMINO13BENZENEDICARBOXYLICACID
5AMINO13ISOPHTHALICACID
5aminobenzene13dicarboxylicacid
5AMINOISOPHTHALICACID
5AMINOMPHTHALICACID
99310
C1=C(C=C(C=C1C(=O)O)N)C(=O)O
C8H7NO4(ANHYDROUS)
InChI=1SC8H7NO4c9624(7(10)11)15(36)8(12)13h13H9H2(H1011)(H1213)
ISOPHTHALICACID5AMINO
ISOPHTHALICACID5AMINO(8CI)
MFCD00002522
ZINC000002504354
ZINC2504354

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.