Vitas-M small molecule compound
{[6-(2-chloropropyl)-4,7-dimethoxy-1,3-benzodioxol-5-yl]methylidene}propanedinitrile
Catalog ID
STK692989
SMILES N#CC(=Cc1c(CC(Cl)C)c(OC)c2c(c1OC)OCO2)C#N
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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 C16H15ClN2O4 MW 334.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15ClN2O4/c1-9(17)4-11-12(5-10(6-18)7-19)14(21-3)16-15(13(11)20-2)22-8-23-16/h5,9H,4,8H2,1-3H3InChIKey
HDBTZGWLJJPTPE-UHFFFAOYSA-NSynonyms
((6(2chloropropyl)47dimethoxy13benzodioxol5yl)methylidene)propanedinitrile
2((6(2chloropropyl)47dimethoxy13benzodioxol5yl)methylidene)propanedinitrile
CC(CC1=C(C(=C2C(=C1OC)OCO2)OC)C=C(C#N)C#N)Cl
InChI=1SC16H15ClN2O4c19(17)41112(510(618)719)14(213)1615(13(11)202)2282316h59H48H213H3
MFCD10039023
ZINC000015085438
ZINC000015085440
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