Vitas-M small molecule compound

(2E)-3-(1,3-benzodioxol-5-yl)-1-phenylprop-2-en-1-one

Catalog ID
STK863111
SMILES O=C(c1ccccc1)/C=C/c1ccc2c(c1)OCO2

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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 C16H12O3 MW 252.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12O3/c17-14(13-4-2-1-3-5-13)8-6-12-7-9-15-16(10-12)19-11-18-15/h1-10H,11H2/b8-6+
InChIKey
ATKADZVINWFQOE-SOFGYWHQSA-N
Synonyms
644-34-8
(2E)3(13benzodioxol5yl)1phenylprop2en1one
(2E)3(2HBENZO(34D)13DIOXOLEN5YL)1PHENYLPROP2EN1ONE
(E)1PHENYL3(13BENZODIOXOL5YL)2PROPEN1ONE
(E)3(13BENZODIOXOL5YL)1PHENYLPROP2EN1ONE
(E)3(benzo(d)(13)dioxol5yl)1phenylprop2en1one
2PROPEN1ONE3(13BENZODIOXOL5YL)1PHENYL
3(13BENZODIOXOL5YL)1PHENYL2PROPEN1ONE
3(2H13BENZODIOXOL5YL)1PHENYLPROP2EN1ONE
3(BENZO(D)(13)DIOXOL5YL)1PHENYLPROP2EN1ONE
3BENZO(13)DIOXOL5YL1PHENYLPROPENONE
644348
C1OC2=C(O1)C=C(C=C2)C=CC(=O)C3=CC=CC=C3
InChI=1SC16H12O3c1714(134213513)8612791516(1012)19111815h110H11H2b86+
MFCD00022990
O=C(c1ccccc1)C=Cc1ccc2c(c1)OCO2
PIPERONALACETOPHENONE
ZINC000004428275
ZINC04428275
ZINC4428275

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Available files

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