Vitas-M small molecule compound

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

Catalog ID
STK555582
SMILES CC(=O)C1C(c2ccco2)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 C15H17NO4 MW 275.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H17NO4/c1-8(17)14-13(11-5-4-6-19-11)12-9(2)20-16-10(12)7-15(14,3)18/h4-6,13-14,18H,7H2,1-3H3
InChIKey
MTRYVHWTJQTMGH-UHFFFAOYSA-N
Synonyms
171199-36-3
1(4(furan2yl)6hydroxy36dimethyl4567tetrahydro21benzoxazol5yl)ethanone
1(4(furan2yl)6hydroxy36dimethyl4567tetrahydrobenzo(c)isoxazol5yl)ethanone
1(4(FURAN2YL)6HYDROXY36DIMETHYL57DIHYDRO4H21BENZOXAZOL5YL)ETHANONE
171199363
CC1=C2C(C(C(CC2=NO1)(C)O)C(=O)C)C3=CC=CO3
InChI=1SC15H17NO4c18(17)1413(115461911)129(2)201610(12)715(143)18h46131418H7H213H3
MFCD00475722
ZINC000005025506
ZINC000104022280

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Available files

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