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Reference substances

Reference substances

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General information

Inventory

EC number:
253-138-0
EC name:
Triisodecyl benzene-1,2,4-tricarboxylate
CAS number:
36631-30-8

No inventory information available

Reference substance information

IUPAC name:
tris(8-methylnonyl) benzene-1,2,4-tricarboxylate
Synonyms
Names:
1,2,4-Benzenetricarboxylic acid, triisodecyl ester

CAS information

CAS number:
36631-30-8

Molecular and structural information

Molecular formula:
C39H66O6
Molecular weight:
630.938
SMILES notation:
O=C(OCCCCCCCC(C)C)c1cc(ccc1C(=O)OCCCCCCCC(C)C)C(=O)OCCCCCCCC(C)C
InChl:
InChI=1S/C39H66O6/c1-31(2)22-16-10-7-13-19-27-43-37(40)34-25-26-35(38(41)44-28-20-14-8-11-17-23-32(3)4)36(30-34)39(42)45-29-21-15-9-12-18-24-33(5)6/h25-26,30-33H,7-24,27-29H2,1-6H3
Structural formula:
Chemical structure