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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
1,6-bis(7-methyloctyl) hexanedioate

Inventory

EC number:
251-646-7
EC name:
Diisononyl adipate
CAS number:
33703-08-1
CAS number:
33703-08-1
Synonyms
Names:
Hexanedioic acid, diisononyl ester
Identifier:
IUPAC name
1,6-bis(7-methyloctyl) hexanedioate
Identifier:
IUPAC name
bis(7-methyloctyl) adipate
Identifier:
other: Molecular formula
C24 H46 O4
Identifier:
other: SMILES notation
CC(C)CCCCCCOC(=O)CCCCC(=O)OCCCCCCC(C)C
Identifier:
other: InChl
InChI=1/C24H46O4/c1-21(2)15-9-5-7-13-19-27-23(25)17-11-12-18-24(26)28-20-14-8-6-10-16-22(3)4/h21-22H,5-20H2,1-4H3
Identifier:
other: SMILES notation
UNCB substance
Identifier:
other: InChl
UVCB susbtance
diisononyl adipate

Molecular and structural information

Molecular formula:
C24H46O4
Molecular weight:
398.62
SMILES notation:
UVCB Substance
InChl:
UVCB Substance
Structural formula:
Chemical structure

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