Vitas-M small molecule compound
6-chloro-7-{[(2E)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-4-propyl-2H-chromen-2-one
Catalog ID
STL456550
SMILES CCCc1cc(=O)oc2c1cc(Cl)c(c2)OC/C=C(/CCC=C(C)C)\C
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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 C22H27ClO3 MW 374.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27ClO3/c1-5-7-17-12-22(24)26-20-14-21(19(23)13-18(17)20)25-11-10-16(4)9-6-8-15(2)3/h8,10,12-14H,5-7,9,11H2,1-4H3/b16-10+InChIKey
KHCHBXFWFJVLJZ-MHWRWJLKSA-NSynonyms
376382-95-5(E)6chloro7((37dimethylocta26dien1yl)oxy)4propyl2Hchromen2one
376382955
6chloro7(((2E)37dimethylocta26dien1yl)oxy)4propyl2Hchromen2one
6CHLORO7((2E)37DIMETHYLOCTA26DIENOXY)4PROPYLCHROMEN2ONE
CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC=C(C)CCC=C(C)C
CCCc1cc(=O)oc2c1cc(Cl)c(c2)OCC=C(CCC=C(C)C)C
InChI=1SC22H27ClO3c157171222(24)26201421(19(23)1318(17)20)25111016(4)96815(2)3h8101214H57911H214H3b1610+
MFCD02925835
ZINC000002139630
ZINC02139630
ZINC2139630
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