Vitas-M small molecule compound

di-tert-butyl (4,6-diazido-1,3,5-triazin-2-yl)(nitro)propanedioate

Catalog ID
STK029551
SMILES [N-]=[N+]=Nc1nc(N=[N+]=[N-])nc(n1)C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)[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 C14H18N10O6 MW 422.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18N10O6/c1-12(2,3)29-8(25)14(24(27)28,9(26)30-13(4,5)6)7-17-10(20-22-15)19-11(18-7)21-23-16/h1-6H3
InChIKey
OCLZZRGKDFNYRP-UHFFFAOYSA-N
Synonyms

(N)=(N+)=Nc1nc(N=(N+)=(N))nc(n1)C(C(=O)OC(C)(C)C)(C(=O)OC(C)(C)C)(N+)(=O)(O)
CC(C)(C)OC(=O)C(C1=NC(=NC(=N1)N=(N+)=(N))N=(N+)=(N))(C(=O)OC(C)(C)C)(N+)(=O)(O)
DITERTBUTYL(46DIAZIDO135TRIAZIN2YL)(NITRO)PROPANEDIOATE
DITERTBUTYL2(46DIAZIDO135TRIAZIN2YL)2NITROPROPANEDIOATE
InChI=1SC14H18N10O6c112(23)298(25)14(24(27)289(26)3013(45)6)71710(202215)1911(187)212316h16H3
MFCD03731010
STK029551
ZINC000013940803
ZINC13940803

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Available files

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