Vitas-M small molecule compound
2-[(3-bromophenyl)amino]-3,5-dinitrobenzoic acid
Catalog ID
STL185561
SMILES Brc1cccc(c1)Nc1c(cc(cc1[N+](=O)[O-])[N+](=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 C13H8BrN3O6 MW 382.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8BrN3O6/c14-7-2-1-3-8(4-7)15-12-10(13(18)19)5-9(16(20)21)6-11(12)17(22)23/h1-6,15H,(H,18,19)InChIKey
RDXJAHMAAUPHGM-UHFFFAOYSA-NSynonyms
65462-63-72((3bromophenyl)amino)35dinitrobenzoicacid
2(3BROMOANILINO)35DINITROBENZOICACID
2(3BROMOPHENYLAMINO)35DINITROBENZOICACID
65462637
Brc1cccc(c1)Nc1c(cc(cc1(N+)(=O)(O))(N+)(=O)(O))C(=O)O
C1=CC(=CC(=C1)Br)NC2=C(C=C(C=C2C(=O)O)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC13H8BrN3O6c1472138(47)151210(13(18)19)59(16(20)21)611(12)17(22)23h1615H(H1819)
MFCD00395322
ZINC000004719229
ZINC4719229
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