Vitas-M small molecule compound

3,3'-methanediylbis[2-hydroxy-5-(propan-2-yl)benzoic acid]

Catalog ID
STL511091
SMILES CC(c1cc(Cc2cc(cc(c2O)C(=O)O)C(C)C)c(c(c1)C(=O)O)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 C21H24O6 MW 372.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24O6/c1-10(2)12-5-14(18(22)16(8-12)20(24)25)7-15-6-13(11(3)4)9-17(19(15)23)21(26)27/h5-6,8-11,22-23H,7H2,1-4H3,(H,24,25)(H,26,27)
InChIKey
UWDQPXHDHDVEQP-UHFFFAOYSA-N
Synonyms
110380-55-7
110380557
1781244
3((3CARBOXY2HYDROXY5PROPAN2YLPHENYL)METHYL)2HYDROXY5PROPAN2YLBENZOICACID
33methanediylbis(2hydroxy5(propan2yl)benzoicacid)
33methylenebis(2hydroxy5isopropylbenzoicacid)
InChI=1SC21H24O6c110(2)12514(18(22)16(812)20(24)25)715613(11(3)4)917(19(15)23)21(26)27h568112223H7H214H3(H2425)(H2627)
MFCD00362619
ZINC000002126626
ZINC2126626

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Available files

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