Vitas-M small molecule compound
6-(2-chloro-6-fluorophenyl)-8,9-dimethoxy-2,3,4,4a,6,10b-hexahydro-1H-benzo[c]chromene
Catalog ID
STK665082
SMILES COc1cc2c(cc1OC)C1CCCCC1OC2c1c(F)cccc1Cl
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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 C21H22ClFO3 MW 376.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClFO3/c1-24-18-10-13-12-6-3-4-9-17(12)26-21(14(13)11-19(18)25-2)20-15(22)7-5-8-16(20)23/h5,7-8,10-12,17,21H,3-4,6,9H2,1-2H3InChIKey
KESZOHROYNGCDI-UHFFFAOYSA-NSynonyms
6(2chloro6fluorophenyl)89dimethoxy2344a610bhexahydro1Hbenzo(c)chromene
COC1=C(C=C2C(OC3CCCCC3C2=C1)C4=C(C=CC=C4Cl)F)OC
InChI=1SC21H22ClFO3c12418101312634917(12)2621(14(13)1119(18)252)2015(22)75816(20)23h57810121721H3469H212H3
MFCD07800463
ZINC000015024249
ZINC000103030156
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