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Reference substances

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IUPAC name:
bis(2-methylpropyl) cyclohexane-1,2-dicarboxylate

Inventory

EC number:
275-069-5
EC name:
Diisobutyl hexahydrophthalate
CAS number:
70969-58-3
CAS number:
70969-58-3
Synonyms
Names:
1,2-Cyclohexanedicarboxylic acid, bis(2-methylpropyl) ester
Diisobuty​l cyclohe​xane-1,2-​dicarboxy​late
Identifier:
IUPAC name
diisobutyl cyclohexane-1,2-dicarboxylate
Identifier:
other: SMILES notation
CC(C)COC(=O)C1CCCCC1C(=O)OCC(C)C
Identifier:
other: InChl
InChI=1/C16H28O4/c1-11(2)9-19-15(17)13-7-5-6-8-14(13)16(18)20-10-12(3)4/h11-14H,5-10H2,1-4H3

Molecular and structural information

Molecular formula:
C16H28O4
Molecular weight:
284.391
SMILES notation:
O=C(OCC(C)C)C1C(C(=O)OCC(C)C)CCCC1
InChl:
InChI=1S/C16H28O4/c1-11(2)9-19-15(17)13-7-5-6-8-14(13)16(18)20-10-12(3)4/h11-14H,5-10H2,1-4H3
Structural formula:
Chemical structure

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