Vitas-M small molecule compound
2,4,6-trimethyl-7-oxocyclohepta-1,3,5-trien-1-yl 4-methylbenzenesulfonate
Catalog ID
STK834105
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1c(C)cc(cc(c1=O)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 C17H18O4S MW 318.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18O4S/c1-11-5-7-15(8-6-11)22(19,20)21-17-14(4)10-12(2)9-13(3)16(17)18/h5-10H,1-4H3InChIKey
MYJFHRLHJGDWLM-UHFFFAOYSA-NSynonyms
118538-90-2(246TRIMETHYL7OXOCYCLOHEPTA135TRIEN1YL)4METHYLBENZENESULFONATE
118538902
246trimethyl7oxocyclohepta135trien1yl4methylbenzenesulfonate
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C(C2=O)C)C)C
InChI=1SC17H18O4Sc1115715(8611)22(1920)211714(4)1012(2)913(3)16(17)18h510H14H3
MFCD01854716
TOLUENE4SULFONICACID246TRIMETHYL7OXOCYCLOHEPTA135TRIENYLESTER
ZINC000002063583
ZINC02063583
ZINC2063583
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