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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

Currently viewing:
IUPAC name:
tris(mixed decyl and octyl)benzene-1,2,4-tricarboxylate

Inventory

EC number:
290-754-9
EC name:
1,2,4-Benzenetricarboxylic acid, mixed decyl and octyl triesters
CAS number:
90218-76-1
CAS number:
90218-76-1
Synonyms
Names:
1,2,4-Benzenetricarboxylic acid, decyl octyl ester
Tri(octyl/decyl)trimellitate
Identifier:
CAS number
67989-23-5
Identifier:
IUPAC name
1,2,4-Benzenetricarboxylic acid, mixed decyl and octyl triesters
Identifier:
IUPAC name
1,2,4-Benzenetricarboxylic acid, mixed decyl and octyl triesters
Identifier:
IUPAC name
tris(mixed decyl and octyl) benzene-1,2,4-tricarboxylate
Identifier:
IUPAC name
tris(mixed decyl and octyl)benzene-1,2,4-tricarboxylate
Identifier:
IUPAC name
tris(mixed decyl and octyl)benzene-1,2,4-tricarboxylate
Identifier:
other: Molecular formula
C33H51O6 - C39H66O6
Identifier:
other: Molecular formula
C33H54O6 to C39H66O6
Identifier:
other: Molecular formula
C41H72O6
Identifier:
other: Molecular formula
C9H3O6 R=C8H17 and/or C10H21
Identifier:
other: InChl
InChI=1S/C33H54O6/c1-7-13-16-25(10-4)22-37-31(34)28-19-20-29(32(35)38-23-26(11-5)17-14-8-2)30(21-28)33(36)39-24-27(12-6)18-15-9-3/h19-21,25-27H,7-18,22-24H2,1-6H3/t25-,26+,27+/m1/s1
Identifier:
other: SMILES notation
Not applicable, UVCB
Identifier:
other: InChl
Not applicable, UVCB
Identifier:
other: SMILES notation
O=C(c1ccc(cc1C(=O)OCCCCCCCC)C(=O)OCCCCCCCC)OCCCCCCCCCC
Identifier:
other: ChemIDplus
System Generated Number: 0090218761
Identifier:
other: InChl
UVCB substance, not univocal InChl notation available
Identifier:
other: InChl
UVCB substance, not univocal InChl notation available
Identifier:
other: SMILES notation
UVCB substance, not univocal SMILE notation available

Molecular and structural information

Molecular formula:
C33H51O6 to C39H66O6
Molecular weight:
>= 546.789 - <= 630.951
SMILES notation:
not applicable, UVCB
InChl:
not applicable, UVCB
Structural formula:
Chemical structure

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Identifier:
CAS number
Identity:
67989-23-5