Registration Dossier

Diss Factsheets

Reference substances

Reference substances

Currently viewing:
IUPAC name:
trioctyl benzene-1,2,4-tricarboxylate

Inventory

EC number:
201-877-4
EC name:
Trioctyl benzene-1,2,4-tricarboxylate
CAS number:
89-04-3
CAS number:
89-04-3
Synonyms
Names:
1,2,4-Benzenetricarboxylic acid, trioctyl ester
Tri-n-octyl trimellitate
Trioctyl 1,2,4-benzenetricarboxylate
Trioctyl trimellitate
tris n-octyl benzene-1,2,4-tricarboxylate
Identifier:
CAS number
39373-94-9
Identifier:
CAS number
76929-92-5
Identifier:
CAS number
82249-09-0
Identifier:
ChemSpider ID
CSID: 6694
Identifier:
ChemSpider ID
CSID:6694
Identifier:
common name
1,2,4-Benzenetricarboxylic acid, trioctyl ester
Identifier:
common name
Tri-n-octyl trimellitate
Identifier:
common name
Trioctyl 1,2,4-benzenetricarboxylate
Identifier:
common name
Trioctyl trimellitate
Identifier:
common name
tris n-octyl benzene-1,2,4-tricarboxylate
Identifier:
PubChem
CID 6960
Identifier:
PubChem
CID: 6960
Identifier:
other: SMILES notation
CCCCCCCCOC(=O)C1=CC(=C(C=C1)C(=O)OCCCCCCCC)C(=O)OCCCCCCCC
Identifier:
other: EPA Substance Registry Services (SRS)
Internal Tracking Number: 12161
trioctyl benzene-1,2,4-tricarboxylate

Molecular and structural information

Molecular formula:
C33H54O6
Molecular weight:
546.778
SMILES notation:
O=C(OCCCCCCCC)c1cc(ccc1C(=O)OCCCCCCCC)C(=O)OCCCCCCCC
InChl:
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
Structural formula:
Chemical structure

Related substances

Identifier:
CAS number
Identity:
82249-09-0, 76929-92-5, 39373-94-9

Categories Display