Vitas-M small molecule compound
(2E)-3-(4-hexylphenyl)but-2-enoic acid
Catalog ID
STK034475
SMILES CCCCCCc1ccc(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 C16H22O2 MW 246.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22O2/c1-3-4-5-6-7-14-8-10-15(11-9-14)13(2)12-16(17)18/h8-12H,3-7H2,1-2H3,(H,17,18)/b13-12+InChIKey
LSWGXOOSIAEHBE-OUKQBFOZSA-NSynonyms
(2E)3(4HEXYLPHENYL)BUT2ENOICACID
(E)3(4HEXYLPHENYL)BUT2ENOICACID
CCCCCCC1=CC=C(C=C1)C(=CC(=O)O)C
CCCCCCc1ccc(cc1)C(=CC(=O)O)C
InChI=1SC16H22O2c1345671481015(11914)13(2)1216(17)18h812H37H212H3(H1718)b1312+
MFCD08050409
STK034475
ZINC000003108534
ZINC3108534
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