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Trioctyl Trimellitate

Catalog Number
ACMA00017219
Product Name
Trioctyl Trimellitate
Category
Polymers
Description
Liquid
IUPAC Name
trioctyl benzene-1,2,4-tricarboxylate
Molecular Weight
546.8g/mol
Molecular Formula
C33H54O6
Canonical SMILES
CCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCC)C(=O)OCCCCCCCC
InChI
InChI=1S/C33H54O6/c1-4-7-10-13-16-19-24-37-31(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/h22-23,27H,4-21,24-26H2,1-3H3
InChI Key
JNXDCMUUZNIWPQ-UHFFFAOYSA-N
Complexity
634
Covalently-Bonded Unit Count
1
EC Number
201-877-4
Exact Mass
546.392039g/mol
Formal Charge
0
Heavy Atom Count
39
MeSH Entry Terms
TOTM;tri-n-octyl trimellitate;trioctyl trimellitate
Monoisotopic Mass
546.392039g/mol
Rotatable Bond Count
27
UNII
9GPJ04URH3
XLogP3
11.7
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