Vitas-M small molecule compound

(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)acetonitrile

Catalog ID
STK357398
SMILES [O-][N+](=O)c1nn(c(n1)Br)CC#N

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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 C4H2BrN5O2 MW 232.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C4H2BrN5O2/c5-3-7-4(10(11)12)8-9(3)2-1-6/h2H2
InChIKey
ZVZRDDCXPQJPKY-UHFFFAOYSA-N
Synonyms
919971-69-0
(5bromo3nitro1H124triazol1yl)acetonitrile
(O)(N+)(=O)c1nn(c(n1)Br)CC#N
2(5bromo3nitro124triazol1yl)acetonitrile
2(5BROMO3NITRO124TRIAZOLYL)ETHANENITRILE
2(5bromo3nitro1H124triazol1yl)acetonitrile
919971690
C(C#N)N1C(=NC(=N1)(N+)(=O)(O))Br
InChI=1SC4H2BrN5O2c5374(10(11)12)89(3)216h2H2
MFCD09261490
ZINC000009142815
ZINC09142815
ZINC9142815

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Available files

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