Vitas-M small molecule compound

1-(4-benzylphenyl)butane-1,3-dione

Catalog ID
STL409539
SMILES O=C(c1ccc(cc1)Cc1ccccc1)CC(=O)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 C17H16O2 MW 252.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16O2/c1-13(18)11-17(19)16-9-7-15(8-10-16)12-14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
InChIKey
HJRNRVPALCWCIU-UHFFFAOYSA-N
Synonyms
1573547-54-2
1(4benzylphenyl)butane13dione
1573547542
CC(=O)CC(=O)C1=CC=C(C=C1)CC2=CC=CC=C2
InChI=1SC17H16O2c113(18)1117(19)169715(81016)12145324614h210H1112H21H3
MFCD27977476
ZINC000096223322
ZINC96223322

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Available files

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