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Reference substances

Reference substances

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General information

Inventory

EC number:
219-280-2
EC name:
Didodecyl fumarate
CAS number:
2402-58-6

No inventory information available

Reference substance information

IUPAC name:
didodecyl but-2-enedioate
Synonyms
Names:
Identifier:
other: SMILES notation
CCCCCCCCCCCCOC(=O)\C=C\C(=O)OCCCCCCCCCCCC
Identifier:
other: InChl
InChI=1/C28H52O4/c1-3-5-7-9-11-13-15-17-19-21-25-31-27(29)23-24-28(30)32-26-22-20-18-16-14-12-10-8-6-4-2/h23-24H,3-22,25-26H2,1-2H3

CAS information

CAS number:
2402-58-6

Molecular and structural information

Molecular formula:
C28H52O4
Molecular weight:
ca. 452.7
SMILES notation:
C(OC(\C=C\C(=O)OCCCCCCCCCCCC)=O)CCCCCCCCCCC
InChl:
1S/C28H52O4/c1-3-5-7-9-11-13-15-17-19-21-25-31-27(29)23-24-28(30)32-26-22-20-18-16-14-12-10-8-6-4-2/h23-24H,3-22,25-26H2,1-2H3/b24-23+
Structural formula:
Chemical structure