Vitas-M small molecule compound

[5-(heptafluoropropyl)-5-hydroxy-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl](4-methoxyphenyl)methanone

Catalog ID
STL363549
SMILES COc1ccc(cc1)C(=O)N1N=C(CC1(O)C(C(C(F)(F)F)(F)F)(F)F)c1ccccc1

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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 C20H15F7N2O3 MW 464.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F7N2O3/c1-32-14-9-7-13(8-10-14)16(30)29-17(31,18(21,22)19(23,24)20(25,26)27)11-15(28-29)12-5-3-2-4-6-12/h2-10,31H,11H2,1H3
InChIKey
SSACCQRVOVAWSL-UHFFFAOYSA-N
Synonyms

(5(1122333heptafluoropropyl)5hydroxy3phenyl4Hpyrazol1yl)(4methoxyphenyl)methanone
(5(heptafluoropropyl)5hydroxy3phenyl45dihydro1Hpyrazol1yl)(4methoxyphenyl)methanone
(5hydroxy5(perfluoropropyl)3phenyl45dihydro1Hpyrazol1yl)(4methoxyphenyl)methanone
COC1=CC=C(C=C1)C(=O)N2C(CC(=N2)C3=CC=CC=C3)(C(C(C(F)(F)F)(F)F)(F)F)O
InChI=1SC20H15F7N2O3c132149713(81014)16(30)2917(3118(2122)19(2324)20(2526)27)1115(2829)125324612h21031H11H21H3
MFCD02164912
ZINC000009310793
ZINC000009310794

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Available files

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