Vitas-M small molecule compound

2-{[(pentafluorophenyl)amino]methyl}phenol

Catalog ID
STL352929
SMILES Oc1ccccc1CNc1c(F)c(F)c(c(c1F)F)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 C13H8F5NO MW 289.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8F5NO/c14-8-9(15)11(17)13(12(18)10(8)16)19-5-6-3-1-2-4-7(6)20/h1-4,19-20H,5H2
InChIKey
KITIVVCYGUAUMA-UHFFFAOYSA-N
Synonyms
329779-37-5
2(((pentafluorophenyl)amino)methyl)phenol
2((23456pentafluoroanilino)methyl)phenol
329779375
C1=CC=C(C(=C1)CNC2=C(C(=C(C(=C2F)F)F)F)F)O
InChI=1SC13H8F5NOc1489(15)11(17)13(12(18)10(8)16)195631247(6)20h141920H5H2
MFCD02670178
ZINC000001817262
ZINC01817262
ZINC1817262

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.