Vitas-M small molecule compound

(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enal

Catalog ID
STK029556
SMILES O=C/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 C10H8O3 MW 176.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H8O3/c11-5-1-2-8-3-4-9-10(6-8)13-7-12-9/h1-6H,7H2/b2-1+
InChIKey
HZUFMSJUNLSDSZ-OWOJBTEDSA-N
Synonyms

(2E)3(13BENZODIOXOL5YL)2PROPENAL
(2E)3(13BENZODIOXOL5YL)PROP2ENAL
(E)3(13BENZODIOXOL5YL)PROP2ENAL
13BENZODIOXOLE5ACROLEIN
2PROPENAL3(13BENZODIOXOL5YL)
3(13BENZODIOXOL5YL)PROP2ENAL
3(34METHYLENEDIOXYPHENYL)PROPENAL
34METHYLENEDIOXYCINNAMALDEHYDE
C1OC2=C(O1)C=C(C=C2)C=CC=O
InChI=1SC10H8O3c11512834910(68)137129h16H7H2b21+
MFCD08050226
O=CC=Cc1ccc2c(c1)OCO2
STK029556
ZINC000001608655
ZINC01608655
ZINC1608655

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.