Vitas-M small molecule compound

4,4',4'',4'''-[cyclohexane-1,1,4,4-tetrayltetrakis(benzene-4,1-diyloxy)]tetrabenzene-1,2-dicarbonitrile

Catalog ID
STK388988
SMILES N#Cc1cc(ccc1C#N)Oc1ccc(cc1)C1(CCC(CC1)(c1ccc(cc1)Oc1ccc(c(c1)C#N)C#N)c1ccc(cc1)Oc1ccc(c(c1)C#N)C#N)c1ccc(cc1)Oc1ccc(c(c1)C#N)C#N

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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 C62H36N8O4 MW 957.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C62H36N8O4/c63-33-41-1-13-57(29-45(41)37-67)71-53-17-5-49(6-18-53)61(50-7-19-54(20-8-50)72-58-14-2-42(34-64)46(30-58)38-68)25-27-62(28-26-61,51-9-21-55(22-10-51)73-59-15-3-43(35-65)47(31-59)39-69)52-11-23-56(24-12-52)74-60-16-4-44(36-66)48(32-60)
InChIKey
NSXOKMRQOCHXHB-UHFFFAOYSA-N
Synonyms
350612-64-5
350612645
4(4(144TRIS(4(34DICYANOPHENOXY)PHENYL)CYCLOHEXYL)PHENOXY)BENZENE12DICARBONITRILE
4444(cyclohexane1144tetrayltetrakis(benzene41diyloxy))tetrabenzene12dicarbonitrile
C1CC(CCC1(C2=CC=C(C=C2)OC3=CC(=C(C=C3)C#N)C#N)C4=CC=C(C=C4)OC5=CC(=C(C=C5)C#N)C#N)(C6=CC=C(C=C6)OC7=CC(=C(C=C7)C#N)C#N)C8=CC=C(C=C8)OC9=CC(=C(C=C9)C#N)C#N
InChI=1SC62H36N8O4c63334111357(2945(41)3767)715317549(61853)61(5071954(20850)725814242(3464)46(3058)3868)252762(2826615192155(221051)735915343(3565)47(3159)3969)52112356(241252)746016444(3666)48(3260)4070h1242932H2528H2
MFCD00301826
ZINC000150354123
ZINC150354123

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Available files

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