Registration Dossier

Reference substances

Reference substances

Currently viewing:

General information

Inventory

EC number:
214-304-8
EC name:
Methyl icosanoate
CAS number:
1120-28-1

No inventory information available

Reference substance information

IUPAC name:
Methyl icosanoate
Synonyms
Names:
Eicosanoic acid, methyl ester
Identifier:
IUPAC name
methyl icosanoate
Identifier:
other: SMILES notation
CCCCCCCCCCCCCCCCCCCC(=O)OC
Identifier:
other: InChl
1S/C21H42O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h3-20H2,1-2H3
Identifier:
other: SMILES notation
CCCCCCCCCCCCCCCCCCCC(=O)OC
Identifier:
other: InChl
InChI=1/C21H42O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h3-20H2,1-2H3

CAS information

CAS number:
1120-28-1

Molecular and structural information

Molecular formula:
C21H42O2
Molecular weight:
ca. 326.56
SMILES notation:
O=C(OC)CCCCCCCCCCCCCCCCCCC
InChl:
1/C21H42O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h3-20H2,1-2H3
Structural formula:
Chemical structure