Vitas-M small molecule compound

1-[4-(4-fluorophenyl)-6-hydroxy-3,6-dimethyl-4,5,6,7-tetrahydro-2,1-benzoxazol-5-yl]ethanone

Catalog ID
STK761035
SMILES CC(=O)C1C(c2ccc(cc2)F)c2c(C)onc2CC1(C)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 C17H18FNO3 MW 303.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18FNO3/c1-9(20)16-15(11-4-6-12(18)7-5-11)14-10(2)22-19-13(14)8-17(16,3)21/h4-7,15-16,21H,8H2,1-3H3
InChIKey
DWXONTTXPOFYOP-UHFFFAOYSA-N
Synonyms
318466-14-7
1(4(4fluorophenyl)6hydroxy36dimethyl4567tetrahydro21benzoxazol5yl)ethanone
1(4(4fluorophenyl)6hydroxy36dimethyl4567tetrahydrobenzo(c)isoxazol5yl)ethanone
1(4(4FLUOROPHENYL)6HYDROXY36DIMETHYL57DIHYDRO4H21BENZOXAZOL5YL)ETHANONE
318466147
CC1=C2C(C(C(CC2=NO1)(C)O)C(=O)C)C3=CC=C(C=C3)F
InChI=1SC17H18FNO3c19(20)1615(114612(18)7511)1410(2)221913(14)817(163)21h47151621H8H213H3
MFCD01820424
ZINC000004177246
ZINC000104142584

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Available files

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