Vitas-M small molecule compound
2-(6-bromo-1,3-benzodioxol-5-yl)-4,6-dinitro-1H-indole
Catalog ID
STK963999
SMILES Brc1cc2OCOc2cc1c1cc2c([nH]1)cc(cc2[N+](=O)[O-])[N+](=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 C15H8BrN3O6 MW 406.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H8BrN3O6/c16-10-5-15-14(24-6-25-15)4-8(10)12-3-9-11(17-12)1-7(18(20)21)2-13(9)19(22)23/h1-5,17H,6H2InChIKey
HCGDTCUDQQXQQL-UHFFFAOYSA-NSynonyms
438463-78-62(6bromo13benzodioxol5yl)46dinitro1Hindole
438463786
Brc1cc2OCOc2cc1c1cc2c((nH)1)cc(cc2(N+)(=O)(O))(N+)(=O)(O)
C1OC2=C(O1)C=C(C(=C2)C3=CC4=C(C=C(C=C4N3)(N+)(=O)(O))(N+)(=O)(O))Br
InChI=1SC15H8BrN3O6c161051514(2462515)48(10)123911(1712)17(18(20)21)213(9)19(22)23h1517H6H2
MFCD01921767
ZINC000002100395
ZINC02100395
ZINC2100395
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