Vitas-M small molecule compound

2-(2,5-dimethylphenyl)-2-oxoethyl 4-tert-butylbenzoate

Catalog ID
STK388481
SMILES Cc1ccc(c(c1)C(=O)COC(=O)c1ccc(cc1)C(C)(C)C)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 C21H24O3 MW 324.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24O3/c1-14-6-7-15(2)18(12-14)19(22)13-24-20(23)16-8-10-17(11-9-16)21(3,4)5/h6-12H,13H2,1-5H3
InChIKey
GTXVBNSGGVNIFZ-UHFFFAOYSA-N
Synonyms
379253-03-9
(2(25DIMETHYLPHENYL)2OXOETHYL)4TERTBUTYLBENZOATE
2(25DIMETHYLPHENYL)2OXOETHYL4(TERTBUTYL)BENZOATE
2(25dimethylphenyl)2oxoethyl4tertbutylbenzoate
379253039
CC1=CC(=C(C=C1)C)C(=O)COC(=O)C2=CC=C(C=C2)C(C)(C)C
InChI=1SC21H24O3c1146715(2)18(1214)19(22)132420(23)1681017(11916)21(34)5h612H13H215H3
MFCD01823438
ZINC000000453292
ZINC00453292
ZINC453292

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Available files

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