Vitas-M small molecule compound
4-(6,6-dimethyl-5,7-dinitro-1,3-diazatricyclo[3.3.1.1~3,7~]dec-2-yl)-2-methoxyphenol
Catalog ID
STK722544
SMILES COc1cc(ccc1O)C1N2CC3(CN1CC(C2)(C3(C)C)[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 C17H22N4O6 MW 378.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4O6/c1-15(2)16(20(23)24)7-18-9-17(15,21(25)26)10-19(8-16)14(18)11-4-5-12(22)13(6-11)27-3/h4-6,14,22H,7-10H2,1-3H3InChIKey
LQOIDXJQLJOPHU-UHFFFAOYSA-NSynonyms
4((1R3S5s7s)66dimethyl57dinitro13diazaadamantan2yl)2methoxyphenol
4(66dimethyl57dinitro13diazatricyclo(3311~37~)dec2yl)2methoxyphenol
CC1(C2(CN3CC1(CN(C2)C3C4=CC(=C(C=C4)O)OC)(N+)(=O)(O))(N+)(=O)(O))C
COc1cc(ccc1O)C1N2CC3(CN1CC(C2)(C3(C)C)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC17H22N4O6c115(2)16(20(23)24)718917(1521(25)26)1019(816)14(18)114512(22)13(611)273h461422H710H213H3
MFCD02946922
ZINC000019321168
ZINC19321168
Check stock
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