Vitas-M small molecule compound
2-[4-(octyloxy)phenyl]-2-oxoethyl 4-hexylbenzoate
Catalog ID
STL327097
SMILES CCCCCCCCOc1ccc(cc1)C(=O)COC(=O)c1ccc(cc1)CCCCCC
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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 C29H40O4 MW 452.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H40O4/c1-3-5-7-9-10-12-22-32-27-20-18-25(19-21-27)28(30)23-33-29(31)26-16-14-24(15-17-26)13-11-8-6-4-2/h14-21H,3-13,22-23H2,1-2H3InChIKey
DMDAYNGTSUBDFF-UHFFFAOYSA-NSynonyms
138295-13-3(2(4OCTOXYPHENYL)2OXOETHYL)4HEXYLBENZOATE
138295133
2(4(octyloxy)phenyl)2oxoethyl4hexylbenzoate
4HEXYLBENZOICACID4(OCTYLOXY)PHENACYLESTER
CCCCCCCCOC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=C(C=C2)CCCCCC
InChI=1SC29H40O4c135791012223227201825(192127)28(30)233329(31)26161424(151726)13118642h1421H3132223H212H3
MFCD00688921
ZINC000097949794
ZINC97949794
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