Vitas-M small molecule compound

6-[(dimethylammonio)methyl]-7-methyl-2-oxo-4-phenyl-2H-chromen-5-olate

Catalog ID
STK621384
SMILES C[NH+](Cc1c(C)cc2c(c1[O-])c(cc(=O)o2)c1ccccc1)C

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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 C19H19NO3 MW 309.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO3/c1-12-9-16-18(19(22)15(12)11-20(2)3)14(10-17(21)23-16)13-7-5-4-6-8-13/h4-10,22H,11H2,1-3H3
InChIKey
BWUQACYBSAXYMN-UHFFFAOYSA-N
Synonyms

6((dimethylammonio)methyl)7methyl2oxo4phenyl2Hchromen5olate
6((dimethylazaniumyl)methyl)7methyl2oxo4phenylchromen5olate
6(DIMETHYLAMINOMETHYL)5HYDROXY7METHYL4PHENYLCHROMEN2ONE
C(NH+)(Cc1c(C)cc2c(c1(O))c(cc(=O)o2)c1ccccc1)C
CC1=CC2=C(C(=CC(=O)O2)C3=CC=CC=C3)C(=C1C(NH+)(C)C)(O)
InChI=1SC19H19NO3c11291618(19(22)15(12)1120(2)3)14(1017(21)2316)137546813h41022H11H213H3
MFCD03469553
ZINC000004540330
ZINC4540330

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Available files

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