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Reference substances

Reference substances

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General information

Inventory

EC number:
237-971-7
EC name:
Dioctadecyl phthalate
CAS number:
14117-96-5

No inventory information available

Reference substance information

IUPAC name:
dioctadecyl phthalate
Synonyms
Names:
1,2-Benzenedicarboxylic acid, dioctadecyl ester
Identifier:
other: SMILES notation
CCCCCCCCCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCCCCCCCCC

CAS information

CAS number:
14117-96-5

Molecular and structural information

Molecular formula:
C44H78O4
Molecular weight:
671.088
SMILES notation:
CCCCCCCCCCCCCCCCCCO(O=)CC1=CC=CC=C1C(=O)OCCCCCCCCCCCCCCCCCC
InChl:
InChI=1/C44H78O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-39-47-43(45)41-37-33-34-38-42(41)44(46)48-40-36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-34,37-38H,3-32,35-36,39-40H2,1-2H3
Structural formula:
Chemical structure