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Reference substances

Reference substances

IUPAC name:
dicyclohexyl phthalate

Inventory

EC number:
201-545-9
EC name:
Dicyclohexyl phthalate
CAS number:
84-61-7
CAS number:
84-61-7
Synonyms
Names:
1,2-Benzenedicarboxylic acid, dicyclohexyl ester
Identifier:
other: InChl
InChI=1S/C20H26O4/c21-19(23-15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)24-16-11-5-2-6-12-16/h7-8,13-16H,1-6,9-12H2
Identifier:
other: SMILES notation
O=C(OC1CCCCC1)C1=C(C=CC=C1)C(=O)OC1CCCCC1
dicyclohexyl phthalate

Molecular and structural information

Molecular formula:
C20H26O4
Molecular weight:
330.418
SMILES notation:
O=C(OC1CCCCC1)c2ccccc2C(=O)OC3CCCCC3
InChl:
InChI=1/C20H26O4/c21-19(23-15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)24-16-11-5-2-6-12-16/h7-8,13-16H,1-6,9-12H2
Structural formula:
Chemical structure

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