Vitas-M small molecule compound
2,3-dicyano-4-(pentyloxy)phenyl 4-(pentyloxy)benzoate
Catalog ID
STK069106
SMILES CCCCCOc1ccc(cc1)C(=O)Oc1ccc(c(c1C#N)C#N)OCCCCC
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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 C25H28N2O4 MW 420.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O4/c1-3-5-7-15-29-20-11-9-19(10-12-20)25(28)31-24-14-13-23(30-16-8-6-4-2)21(17-26)22(24)18-27/h9-14H,3-8,15-16H2,1-2H3InChIKey
NQOTXYNZSMFULC-UHFFFAOYSA-NSynonyms
67042-21-1(23DICYANO4PENTOXYPHENYL)4PENTOXYBENZOATE
23DICYANO4(PENTYLOXY)PHENYL4(PENTYLOXY)BENZOATE
67042211
BENZOICACID4(PENTYLOXY)23DICYANO4(PENTYLOXY)PHENYLESTER
CCCCCOC1=CC=C(C=C1)C(=O)OC2=C(C(=C(C=C2)OCCCCC)C#N)C#N
CCCCCOc1ccc(cc1)C(=O)Oc1ccc(c(c1C#N)C#N)OCCCCC
InChI=1SC25H28N2O4c135715292011919(101220)25(28)3124141323(30168642)21(1726)22(24)1827h914H381516H212H3
MFCD00187199
STK069106
ZINC000004256497
ZINC04256497
ZINC4256497
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