Vitas-M small molecule compound

N-(2,2-dinitropropyl)-4-methyl-2,3,6-trinitroaniline

Catalog ID
STK669879
SMILES [O-][N+](=O)c1cc(C)c(c(c1NCC([N+](=O)[O-])([N+](=O)[O-])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 C10H10N6O10 MW 374.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H10N6O10/c1-5-3-6(12(17)18)7(9(14(21)22)8(5)13(19)20)11-4-10(2,15(23)24)16(25)26/h3,11H,4H2,1-2H3
InChIKey
KPHRUIADSSDCFH-UHFFFAOYSA-N
Synonyms

(22DINITROPROPYL)(4METHYL236TRINITROPHENYL)AMINE
(O)(N+)(=O)c1cc(C)c(c(c1NCC((N+)(=O)(O))((N+)(=O)(O))C)(N+)(=O)(O))(N+)(=O)(O)
CC1=CC(=C(C(=C1(N+)(=O)(O))(N+)(=O)(O))NCC(C)((N+)(=O)(O))(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC10H10N6O10c1536(12(17)18)7(9(14(21)22)8(5)13(19)20)11410(215(23)24)16(25)26h311H4H212H3
MFCD00744934
N(22dinitropropyl)4methyl236trinitroaniline
ZINC000033354444
ZINC33354444

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Available files

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