Vitas-M small molecule compound

4-[2-(tert-butoxycarbonyl)hydrazinyl]-3,5-dinitrobenzoic acid

Catalog ID
STK331143
SMILES O=C(OC(C)(C)C)NNc1c(cc(cc1[N+](=O)[O-])C(=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 C12H14N4O8 MW 342.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14N4O8/c1-12(2,3)24-11(19)14-13-9-7(15(20)21)4-6(10(17)18)5-8(9)16(22)23/h4-5,13H,1-3H3,(H,14,19)(H,17,18)
InChIKey
WGLWIOGTHLHVFB-UHFFFAOYSA-N
Synonyms
951924-36-0
4(2((2methylpropan2yl)oxycarbonyl)hydrazinyl)35dinitrobenzoicacid
4(2(tertbutoxycarbonyl)hydrazinyl)35dinitrobenzoicacid
951924360
CC(C)(C)OC(=O)NNC1=C(C=C(C=C1(N+)(=O)(O))C(=O)O)(N+)(=O)(O)
InChI=1SC12H14N4O8c112(23)2411(19)141397(15(20)21)46(10(17)18)58(9)16(22)23h4513H13H3(H1419)(H1718)
MFCD01593619
O=C(OC(C)(C)C)NNc1c(cc(cc1(N+)(=O)(O))C(=O)O)(N+)(=O)(O)
ZINC000018194220
ZINC18194220

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Available files

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