tris[3,5-bis[2,6-di(propan-2-yl)phenyl]phenyl]phosphane

Systemtic Name: tris[3,5-bis[2,6-di(propan-2-yl)phenyl]phenyl]phosphane Openeye Name: tris[3,5-bis(2,6-diisopropylphenyl)phenyl]phosphane CAS Name: tris[3,5-bis[2,6-di(propan-2-yl)phenyl]phenyl]phosphine IUPAC Name: tris[3,5-bis[2,6-di(propan-2-yl)phenyl]phenyl]phosphane Traditional Name: tris[3,5-bis(2,6-diisopropylphenyl)phenyl]phosphine Formula: C90H111P MolecularWeight: 1223.818101

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)C2=CC(=CC(=C2)P(C3=CC(=CC(=C3)C4=C(C=CC=C4C(C)C)C(C)C)C5=C(C=CC=C5C(C)C)C(C)C)C6=CC(=CC(=C6)C7=C(C=CC=C7C(C)C)C(C)C)C8=C(C=CC=C8C(C)C)C(C)C)C9=C(C=CC=C9C(C)C)C(C)C

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)C2=CC(=CC(=C2)P(C3=CC(=CC(=C3)C4=C(C=CC=C4C(C)C)C(C)C)C5=C(C=CC=C5C(C)C)C(C)C)C6=CC(=CC(=C6)C7=C(C=CC=C7C(C)C)C(C)C)C8=C(C=CC=C8C(C)C)C(C)C)C9=C(C=CC=C9C(C)C)C(C)C

InChI

InChI=1S/C90H111P/c1-52(2)73-31-25-32-74(53(3)4)85(73)64-43-65(86-75(54(5)6)33-26-34-76(86)55(7)8)47-70(46-64)91(71-48-66(87-77(56(9)10)35-27-36-78(87)57(11)12)44-67(49-71)88-79(58(13)14)37-28-38-80(88)59(15)16)72-50-68(89-81(60(17)18)39-29-40-82(89)61(19)20)45-69(51-72)90-83(62(21)22)41-30-42-84(90)63(23)24/h25-63H,1-24H3