Vitas-M small molecule compound
2-bromo-4-(propan-2-yl)phenyl 2-nitrobenzoate
Catalog ID
STL062870
SMILES Brc1cc(ccc1OC(=O)c1ccccc1[N+](=O)[O-])C(C)C
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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 C16H14BrNO4 MW 364.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14BrNO4/c1-10(2)11-7-8-15(13(17)9-11)22-16(19)12-5-3-4-6-14(12)18(20)21/h3-10H,1-2H3InChIKey
MMIRWTRUEHNMOV-UHFFFAOYSA-NSynonyms
(2BROMO4PROPAN2YLPHENYL)2NITROBENZOATE
2BROMO4(METHYLETHYL)PHENYL2NITROBENZOATE
2bromo4(propan2yl)phenyl2nitrobenzoate
Brc1cc(ccc1OC(=O)c1ccccc1(N+)(=O)(O))C(C)C
CC(C)C1=CC(=C(C=C1)OC(=O)C2=CC=CC=C2(N+)(=O)(O))Br
InChI=1SC16H14BrNO4c110(2)117815(13(17)911)2216(19)12534614(12)18(20)21h310H12H3
MFCD04107349
ZINC000002857004
ZINC02857004
ZINC2857004
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