Vitas-M small molecule compound

4-nitro-1,1'-di(tricyclo[3.3.1.1~3,7~]dec-1-yl)-1H,1'H-3,4'-bipyrazole

Catalog ID
STL390247
SMILES [O-][N+](=O)c1cn(nc1c1cnn(c1)C12CC3CC(C2)CC(C1)C3)C12CC3CC(C2)CC(C1)C3

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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 C26H33N5O2 MW 447.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N5O2/c32-31(33)23-15-30(26-10-19-4-20(11-26)6-21(5-19)12-26)28-24(23)22-13-27-29(14-22)25-7-16-1-17(8-25)3-18(2-16)9-25/h13-21H,1-12H2
InChIKey
WOJHMXRXJNCHFQ-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1cn(nc1c1cnn(c1)C12CC3CC(C2)CC(C1)C3)C12CC3CC(C2)CC(C1)C3
1(1ADAMANTYL)3(1(1ADAMANTYL)PYRAZOL4YL)4NITROPYRAZOLE
4nitro11di(tricyclo(3311~37~)dec1yl)1H1H34bipyrazole
4NITRO34BIS(1(1ADAMANTYL)1HPYRAZOLE)
C1C2CC3CC1CC(C2)(C3)N4C=C(C=N4)C5=NN(C=C5(N+)(=O)(O))C67CC8CC(C6)CC(C8)C7
InChI=1SC26H33N5O2c3231(33)231530(261019420(1126)621(519)1226)2824(23)22132729(1422)25716117(825)318(216)925h1321H112H2
MFCD03075161
ZINC000008454962
ZINC08454962
ZINC8454962

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Available files

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