Vitas-M small molecule compound

4,4'-(1,1,1,3,3,3-hexafluoropropane-2,2-diyl)bis[N-(2,4-dinitrophenyl)benzamide]

Catalog ID
STK367784
SMILES O=C(c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)c1ccc(cc1)C(=O)Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])Nc1ccc(cc1[N+](=O)[O-])[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 C29H16F6N6O10 MW 722.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H16F6N6O10/c30-28(31,32)27(29(33,34)35,17-5-1-15(2-6-17)25(42)36-21-11-9-19(38(44)45)13-23(21)40(48)49)18-7-3-16(4-8-18)26(43)37-22-12-10-20(39(46)47)14-24(22)41(50)51/h1-14H,(H,36,42)(H,37,43)
InChIKey
QHSZTAMKRZCBAS-UHFFFAOYSA-N
Synonyms

44(111333hexafluoropropane22diyl)bis(N(24dinitrophenyl)benzamide)
C1=CC(=CC=C1C(=O)NC2=C(C=C(C=C2)(N+)(=O)(O))(N+)(=O)(O))C(C3=CC=C(C=C3)C(=O)NC4=C(C=C(C=C4)(N+)(=O)(O))(N+)(=O)(O))(C(F)(F)F)C(F)(F)F
InChI=1SC29H16F6N6O10c3028(3132)27(29(3334)35175115(2617)25(42)362111919(38(44)45)1323(21)40(48)49)187316(4818)26(43)3722121020(39(46)47)1424(22)41(50)51h114H(H3642)(H3743)
MFCD00309079
N(24DINITROPHENYL)(4(1(4(N(24DINITROPHENYL)CARBAMOYL)PHENYL)222TRIFLUORO1(TRIFLUOROMETHYL)ETHYL)PHENYL)CARBOXAMIDE
N(24dinitrophenyl)4(2(4((24dinitrophenyl)carbamoyl)phenyl)111333hexafluoropropan2yl)benzamide
O=C(c1ccc(cc1)C(C(F)(F)F)(C(F)(F)F)c1ccc(cc1)C(=O)Nc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O))Nc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
ZINC000150399080
ZINC150399080

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Available files

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