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Reference substances

Reference substances

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General information

Inventory

EC number:
215-553-5
EC name:
Diisooctyl adipate
CAS number:
1330-86-5

No inventory information available

Reference substance information

IUPAC name:
bis(6-methylheptyl) adipate
Synonyms
Names:
Hexanedioic acid, diisooctyl ester

CAS information

CAS number:
1330-86-5

Molecular and structural information

Molecular formula:
C22H42O4
Molecular weight:
370.567
SMILES notation:
CC(C)CCCCCOC(=O)CCCCC(=O)OCCCCCC(C)C
InChl:
InChI=1/C22H42O4/c1-19(2)13-7-5-11-17-25-21(23)15-9-10-16-22(24)26-18-12-6-8-14-20(3)4/h19-20H,5-18H2,1-4H3
Structural formula:
Chemical structure