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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

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IUPAC name:
Methyl dodecanoate

Inventory

EC number:
203-911-3
EC name:
Methyl laurate
CAS number:
111-82-0
CAS number:
111-82-0
Synonyms
Names:
Dodecanoic acid, methyl ester
Identifier:
IUPAC name
methyl laurate
Identifier:
other: SMILES notation
CCCCCCCCCCCC(=O)OC
Identifier:
other: InChl
InChI=1/C13H26O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h3-12H2,1-2H3
Identifier:
other: SMILES notation
O=C(OC)CCCCCCCCCCC

Molecular and structural information

Molecular formula:
C13H26O2
Molecular weight:
ca. 214.35
SMILES notation:
O=C(CCCCCCCCCCC)OC
InChl:
1/C13H26O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h3-12H2,1-2H3
Structural formula:
Chemical structure

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