Vitas-M small molecule compound
5-[(2-hydroxyethyl)amino]-4,6-dinitro-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STL431690
SMILES OCCNc1c(cc2c(c1[N+](=O)[O-])[nH]c(=O)[nH]2)[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 C9H9N5O6 MW 283.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H9N5O6/c15-2-1-10-7-5(13(17)18)3-4-6(8(7)14(19)20)12-9(16)11-4/h3,10,15H,1-2H2,(H2,11,12,16)InChIKey
KYMTYHWWSGHHQC-UHFFFAOYSA-NSynonyms
5((2hydroxyethyl)amino)46dinitro13dihydro2Hbenzimidazol2one
5(2HYDROXYETHYLAMINO)46DINITRO13DIHYDROBENZIMIDAZOL2ONE
5(2HYDROXYETHYLAMINO)46DINITRO13DIHYDROBENZOIMIDAZOL2ONE
C1=C2C(=C(C(=C1(N+)(=O)(O))NCCO)(N+)(=O)(O))NC(=O)N2
InChI=1SC9H9N5O6c15211075(13(17)18)346(8(7)14(19)20)129(16)114h31015H12H2(H2111216)
MFCD00420611
OCCNc1c(cc2c(c1(N+)(=O)(O))(nH)c(=O)(nH)2)(N+)(=O)(O)
ZINC000013555003
ZINC13555003
Check stock
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Check stock on Vitas-MAvailable files
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