Vitas-M small molecule compound
5-(butan-2-yl)-4-hydroxybenzene-1,3-dicarboxylic acid
Catalog ID
STL511094
SMILES CCC(c1cc(cc(c1O)C(=O)O)C(=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 C12H14O5 MW 238.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H14O5/c1-3-6(2)8-4-7(11(14)15)5-9(10(8)13)12(16)17/h4-6,13H,3H2,1-2H3,(H,14,15)(H,16,17)InChIKey
JPARVKBAXSLIOA-UHFFFAOYSA-NSynonyms
13253-09-313253093
13BENZENEDICARBOXYLICACID4HYDROXY5(1METHYLPROPYL)
4371922
5(butan2yl)4hydroxybenzene13dicarboxylicacid
5(SECBUTYL)4HYDROXYISOPHTHALICACID
5BUTAN2YL4HYDROXYBENZENE13DICARBOXYLICACID
5SECBUTYL4HYDROXYISOPHTHALICACID
InChI=1SC12H14O5c136(2)847(11(14)15)59(10(8)13)12(16)17h4613H3H212H3(H1415)(H1617)
MFCD02925616
ZINC000004028976
ZINC000004028977
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