Vitas-M small molecule compound
(2E)-3-(6-chloro-4H-1,3-benzodioxin-8-yl)-1-(2-hydroxy-3-methylphenyl)prop-2-en-1-one
Catalog ID
STL322848
SMILES Clc1cc(/C=C/C(=O)c2cccc(c2O)C)c2c(c1)COCO2
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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 C18H15ClO4 MW 330.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClO4/c1-11-3-2-4-15(17(11)21)16(20)6-5-12-7-14(19)8-13-9-22-10-23-18(12)13/h2-8,21H,9-10H2,1H3/b6-5+InChIKey
IDRVBFSCBHDQGW-AATRIKPKSA-NSynonyms
170807-44-0(2E)3(6chloro4H13benzodioxin8yl)1(2hydroxy3methylphenyl)prop2en1one
(E)3(6CHLORO4H13BENZODIOXIN8YL)1(2HYDROXY3METHYLPHENYL)PROP2EN1ONE
(E)3(6chloro4Hbenzo(d)(13)dioxin8yl)1(2hydroxy3methylphenyl)prop2en1one
170807440
CC1=CC=CC(=C1O)C(=O)C=CC2=CC(=CC3=C2OCOC3)Cl
Clc1cc(C=CC(=O)c2cccc(c2O)C)c2c(c1)COCO2
InChI=1SC18H15ClO4c11132415(17(11)21)16(20)6512714(19)813922102318(12)13h2821H910H21H3b65+
MFCD00710046
ZINC000004158408
ZINC04158408
ZINC4158408
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