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Reference substances

Reference substances

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General information

Inventory

EC number:
271-091-4
EC name:
1,2-Benzenedicarboxylic acid, di-C9-11-branched alkyl esters, C10-rich
CAS number:
68515-49-1

No inventory information available

Reference substance information

Synonyms
Names:
1,2-Benzenedicarboxylic acid, di-C9-11-branched alkyl esters, C10 rich
1,2-Benzenedicarboxylic acid, di-C9-11-branched alkyl esters, C10-rich
Identifier:
CAS number
68515-49-1
Identifier:
IUPAC name
1,2-Benzenedicarboxylic acid di(C=9-11) branched alkyl esters, (C=10)-rich
Identifier:
IUPAC name
1,2-Benzenedicarboxylic acid, di-C9-11-branched alkyl esters, C10-rich
Identifier:
IUPAC name
1,2-Benzenedicarboxylic acid, di-C9-11-branched alkyl esters, C10-rich
Identifier:
IUPAC name
bis(8-methylnonyl) phthalate
Identifier:
other: Molecular formula
6 substances from: C26H42O4 (C9-C9 diester) to C30H50O4 (C11-C11 diester)
Identifier:
other: Molecular formula
C28 H46 O4
Identifier:
other: Molecular formula
C28H46O4
Identifier:
other: SMILES notation
CC(C)CCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC(C)C
Identifier:
other: InChl
InChI=1/C28H46O4/c1-23(2)17-11-7-5-9-15-21-31-27(29)25-19-13-14-20-26(25)28(30)32-22-16-10-6-8-12-18-24(3)4/h13-14,19-20,23-24H,5-12,15-18,21-22H2,1-4H3
Identifier:
other: Molecular formula
Not applicable, not a single constituent
Identifier:
other: SMILES notation
Not applicable, not a single constituent
Identifier:
other: InChl
Not applicable, not a single constituent
Identifier:
other: SMILES notation
Not applicable, not a single constituent substance (see remarks below)
Identifier:
other: InChl
Not applicable, not a single constituent substance (see remarks below)
Not available; not a single isomer substance (see remarks below)

CAS information

CAS number:
68515-49-1

Related substances

Identifiers of related substances
Identifier:
CAS number
Identity:
68515-49-1

Molecular and structural information

Molecular formula:
C28 H46 O4
Molecular weight:
ca. 447
SMILES notation:
Not applicable, not a single constituent substance (see remarks below)
InChl:
Not applicable
Structural formula:
Chemical structure