Vitas-M small molecule compound
(2E)-3-(4-butylphenyl)but-2-enoic acid
Catalog ID
STK041312
SMILES CCCCc1ccc(cc1)/C(=C/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 C14H18O2 MW 218.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H18O2/c1-3-4-5-12-6-8-13(9-7-12)11(2)10-14(15)16/h6-10H,3-5H2,1-2H3,(H,15,16)/b11-10+InChIKey
HIIFUPIDHKSFGO-ZHACJKMWSA-NSynonyms
(2E)3(4BUTYLPHENYL)BUT2ENOICACID
(E)3(4BUTYLPHENYL)BUT2ENOICACID
CCCCC1=CC=C(C=C1)C(=CC(=O)O)C
CCCCc1ccc(cc1)C(=CC(=O)O)C
InChI=1SC14H18O2c1345126813(9712)11(2)1014(15)16h610H35H212H3(H1516)b1110+
MFCD00807397
STK041312
ZINC000003108539
ZINC3108539
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