Vitas-M small molecule compound

N-(3-chloro-4-fluorophenyl)-2,4,6-trinitrobenzamide

Catalog ID
STK689393
SMILES O=C(c1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])Nc1ccc(c(c1)Cl)F

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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 C13H6ClFN4O7 MW 384.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H6ClFN4O7/c14-8-3-6(1-2-9(8)15)16-13(20)12-10(18(23)24)4-7(17(21)22)5-11(12)19(25)26/h1-5H,(H,16,20)
InChIKey
OYFJBEPAJLXDIB-UHFFFAOYSA-N
Synonyms

C1=CC(=C(C=C1NC(=O)C2=C(C=C(C=C2(N+)(=O)(O))(N+)(=O)(O))(N+)(=O)(O))Cl)F
InChI=1SC13H6ClFN4O7c14836(129(8)15)1613(20)1210(18(23)24)47(17(21)22)511(12)19(25)26h15H(H1620)
MFCD08142470
N(3CHLORO4FLUOROPHENYL)246TRINITROBENZAMIDE
O=C(c1c(cc(cc1(N+)(=O)(O))(N+)(=O)(O))(N+)(=O)(O))Nc1ccc(c(c1)Cl)F
ZINC000100222063
ZINC100222063

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Available files

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