Vitas-M small molecule compound

2-[(2,4-dinitrophenyl)sulfonyl]-1,3-benzoxazole

Catalog ID
STK762056
SMILES [O-][N+](=O)c1ccc(c(c1)[N+](=O)[O-])S(=O)(=O)c1nc2c(o1)cccc2

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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 C13H7N3O7S MW 349.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H7N3O7S/c17-15(18)8-5-6-12(10(7-8)16(19)20)24(21,22)13-14-9-3-1-2-4-11(9)23-13/h1-7H
InChIKey
HMQSTSNRCJIJMS-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1ccc(c(c1)(N+)(=O)(O))S(=O)(=O)c1nc2c(o1)cccc2
1(BENZOXAZOL2YLSULFONYL)24DINITROBENZENE
2((24DINITROPHENYL)SULFONYL)13BENZOXAZOLE
2(24DINITROBENZENESULFONYL)BENZOOXAZOLE
2(24DINITROPHENYL)SULFONYL13BENZOXAZOLE
C1=CC=C2C(=C1)N=C(O2)S(=O)(=O)C3=C(C=C(C=C3)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC13H7N3O7Sc1715(18)85612(10(78)16(19)20)24(2122)13149312411(9)2313h17H
MFCD01079537
ZINC000003670887
ZINC03670887
ZINC3670887

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Available files

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