Vitas-M small molecule compound

methyl 5-(5,5-dinitro-2-oxopiperidin-1-yl)-4,4-dinitropentanoate

Catalog ID
STL330777
SMILES COC(=O)CCC([N+](=O)[O-])([N+](=O)[O-])CN1CC(CCC1=O)([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 C11H15N5O11 MW 393.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H15N5O11/c1-27-9(18)3-5-11(15(23)24,16(25)26)7-12-6-10(13(19)20,14(21)22)4-2-8(12)17/h2-7H2,1H3
InChIKey
GXGFZSNJOBQYAO-UHFFFAOYSA-N
Synonyms
54827-84-8
54827848
COC(=O)CCC((N+)(=O)(O))((N+)(=O)(O))CN1CC(CCC1=O)((N+)(=O)(O))(N+)(=O)(O)
COC(=O)CCC(CN1CC(CCC1=O)((N+)(=O)(O))(N+)(=O)(O))((N+)(=O)(O))(N+)(=O)(O)
InChI=1SC11H15N5O11c1279(18)3511(15(23)2416(25)26)712610(13(19)2014(21)22)428(12)17h27H21H3
methyl5(55dinitro2oxopiperidin1yl)44dinitropentanoate
MFCD00814787
ZINC000100798943
ZINC100798943

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.