66988-04-3 Purity
95%
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Specification
The molecular formula of TRI(N-OCTYL-N-DECYL) TRIMELLITATE is C72H120O12.
Some synonyms of TRI(N-OCTYL-N-DECYL) TRIMELLITATE are 1,2,4-Benzenetricarboxylic acid, tris(octyl/decyl) ester and trioctyl benzene-1,2,4-tricarboxylate; tris-decyl benzene-1,2,4-tricarboxylate.
The molecular weight of TRI(N-OCTYL-N-DECYL) TRIMELLITATE is 1177.7 g/mol.
TRI(N-OCTYL-N-DECYL) TRIMELLITATE was created on March 27, 2005.
TRI(N-OCTYL-N-DECYL) TRIMELLITATE was last modified on October 21, 2023.
The two component compounds of TRI(N-OCTYL-N-DECYL) TRIMELLITATE are CID 61333 (1,2,4-Benzenetricarboxylic acid, tris(decyl) ester) and CID 6960 (Trioctyl benzene-1,2,4-tricarboxylate).
The IUPAC name of TRI(N-OCTYL-N-DECYL) TRIMELLITATE is trioctyl benzene-1,2,4-tricarboxylate; tris-decyl benzene-1,2,4-tricarboxylate.
The InChI of TRI(N-OCTYL-N-DECYL) TRIMELLITATE is InChI=1S/C39H66O6.C33H54O6/c1-4-7-10-13-16-19-22-25-30-43-37(40)34-28-29-35(38(41)44-31-26-23-20-17-14-11-8-5-2)36(33-34)39(42)45-32-27-24-21-18-15-12-9-6-3;1-4-7-10-13-16-19-24-37-31(34)28-22-23-29(32(35)38-25-20-17-14-11-8-5-2)30(27-28)33(36)39-26-21-18-15-12-9-6-3/h28-29,33H,4-27,30-32H2,1-3H3;22-23,27H,4-21,24-26H2,1-3H3.
The InChIKey of TRI(N-OCTYL-N-DECYL) TRIMELLITATE is LGBBBRJCHQVTRG-UHFFFAOYSA-N.
The computed properties of TRI(N-OCTYL-N-DECYL) TRIMELLITATE include a hydrogen bond donor count of 0, a hydrogen bond acceptor count of 12, a rotatable bond count of 60, an exact mass of 1176.87797926 g/mol, a topological polar surface area of 158Ų, a heavy atom count of 84, and a complexity of 1360.