Registration Dossier

Reference substances

Reference substances

Currently viewing:

General information

Inventory

EC number:
290-580-3
EC name:
1,2-Benzenedicarboxylic acid, di-C16-18-alkyl esters
CAS number:
90193-76-3

No inventory information available

Reference substance information

Synonyms
Names:
CETYLSTEARYLPHTHALATE
Identifier:
CAS number
90193-76-3
Identifier:
IUPAC name
1,2-Benzenedicarboxylic acid di C16-18(even numberd)-alkyl esters
Identifier:
IUPAC name
1,2-Benzenedicarboxylic acid, di-C16-18 (even numbered) -alkyl esters
Identifier:
IUPAC name
1,2-Benzenedicarboxylic acid, di-C16-18-alkyl esters
Identifier:
IUPAC name
290-580-3
Identifier:
IUPAC name
90193-76-3
Identifier:
other: Molecular formula
C40H70O4 C42H74O4 C44H78O4
Identifier:
other: Molecular formula
C40H70O4, C42H74O4, C44H78O4
Identifier:
other: SMILES notation
CCCCCCCCCCCCCCCCO(O=)CC1=CC=CC=C1C(=O)OCCCCCCCCCCCCCCCC CCCCCCCCCCCCCCCCO(O=)CC1=CC=CC=C1C(=O)OCCCCCCCCCCCCCCCCCC CCCCCCCCCCCCCCCCCCO(O=)CC1=CC=CC=C1C(=O)OCCCCCCCCCCCCCCCC CCCCCCCCCCCCCCCCCCO(O=)CC1=CC=CC=C1C(=O)OCCCCCCCCCCCCCCCCCC
Identifier:
other: SMILES notation
Example for SMILES code: CCCCCCCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCCCCCCC and CCCCCCCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCCCCCCCCC and CCCCCCCCCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCCCCCCCCC
1,2-Benzenedicarboxylic acid, di-C16-18(even numbered)-alkyl esters

CAS information

CAS number:
90193-76-3

Molecular and structural information

Molecular formula:
C40H70O4
C42H74O4
C44H78O4
Molecular weight:
>= 614.981 - <= 671.088
SMILES notation:
CCCCCCCCCCCCCCCCO(O=)CC1=CC=CC=C1C(=O)OCCCCCCCCCCCCCCCC
CCCCCCCCCCCCCCCCO(O=)CC1=CC=CC=C1C(=O)OCCCCCCCCCCCCCCCCCC
CCCCCCCCCCCCCCCCCCO(O=)CC1=CC=CC=C1C(=O)OCCCCCCCCCCCCCCCC
CCCCCCCCCCCCCCCCCCO(O=)CC1=CC=CC=C1C(=O)OCCCCCCCCCCCCCCCCCC
InChl:
Example for InChI:
InChI=1/C40H70O4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31-35-43-39(41)37-33-29-30-34-38(37)40(42)44-36-32-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-30,33-34H,3-28,31-32,35-36H2,1-2H3
and
InChI=1/C42H74O4/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-34-38-46-42(44)40-36-32-31-35-39(40)41(43)45-37-33-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h31-32,35-36H,3-30,33-34,37-38H2,1-2H3
and
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