Vitas-M small molecule compound
3-ethyl-2-methyl-5-phenyl-1,3-benzoxazol-3-ium
Catalog ID
STK367809
SMILES CC[n+]1c(C)oc2c1cc(cc2)c1ccccc1
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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 C16H16NO MW 238.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16NO/c1-3-17-12(2)18-16-10-9-14(11-15(16)17)13-7-5-4-6-8-13/h4-11H,3H2,1-2H3/q+1InChIKey
RCJIJPZYPFGZEW-UHFFFAOYSA-NSynonyms
63467-98-13ethyl2methyl5phenyl13benzoxazol3ium
3ETHYL2METHYL5PHENYLBENZOOXAZOL3IUM
3ETHYL2METHYL5PHENYLBENZOXAZOLIUM
63467981
CC(N+)1=C(OC2=C1C=C(C=C2)C3=CC=CC=C3)C
CC(n+)1c(C)oc2c1cc(cc2)c1ccccc1
InChI=1SC16H16NOc131712(2)181610914(1115(16)17)137546813h411H3H212H3q+1
MFCD01003587
ZINC00357716
ZINC357716
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