Vitas-M small molecule compound

6-(2-chloropropyl)-4,7-dimethoxy-1,3-benzodioxole-5-carbaldehyde

Catalog ID
STK692980
SMILES COc1c(C=O)c(CC(Cl)C)c(c2c1OCO2)OC

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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 C13H15ClO5 MW 286.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15ClO5/c1-7(14)4-8-9(5-15)11(17-3)13-12(10(8)16-2)18-6-19-13/h5,7H,4,6H2,1-3H3
InChIKey
VQAOJDKURVRARQ-UHFFFAOYSA-N
Synonyms

13BENZODIOXOLE5CARBOXALDEHYDE6(2CHLOROPROPYL)47DIMETHOXY
6(2chloropropyl)47dimethoxy13benzodioxole5carbaldehyde
6(2CHLOROPROPYL)47DIMETHOXY2HBENZO(D)13DIOXOLENE5CARBALDEHYDE
CC(CC1=C(C(=C2C(=C1OC)OCO2)OC)C=O)Cl
InChI=1SC13H15ClO5c17(14)489(515)11(173)1312(10(8)162)1861913h57H46H213H3
MFCD10037629
ZINC000014988183
ZINC000014988186

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Available files

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