Vitas-M small molecule compound

2-{1-[(2-hydroxyethyl)amino]ethylidene}-1H-indene-1,3(2H)-dione

Catalog ID
STK150100
SMILES OCCN/C(=C/1\C(=O)c2c(C1=O)cccc2)/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 C13H13NO3 MW 231.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13NO3/c1-8(14-6-7-15)11-12(16)9-4-2-3-5-10(9)13(11)17/h2-5,14-15H,6-7H2,1H3
InChIKey
DHTYOYFSYORYSG-UHFFFAOYSA-N
Synonyms
80839-28-7
2(1((2HYDROXYETHYL)AMINO)ETHYLIDENE)1HINDENE13(2H)DIONE
2(1(2HYDROXYETHYLAMINO)ETHYLIDENE)INDAN13DIONE
2(1(2HYDROXYETHYLAMINO)ETHYLIDENE)INDENE13DIONE
80839287
CC(=C1C(=O)C2=CC=CC=C2C1=O)NCCO
InChI=1SC13H13NO3c18(146715)1112(16)9423510(9)13(11)17h251415H67H21H3
MFCD00446051
OCCNC(=C1C(=O)c2c(C1=O)cccc2)C
ZINC000100554939
ZINC100554939

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Available files

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