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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

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Reference substances

Reference substances

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IUPAC name:
butyl 4-oxopentanoate

Inventory

EC number:
218-143-4
EC name:
N-butyl 4-oxopentanoate
CAS number:
2052-15-5
CAS number:
2052-15-5
Synonyms
Names:
Levulinic acid, butyl ester
Pentanoic acid, 4-oxo-, butyl ester
butyl 4-oxopentanoate

Molecular and structural information

Molecular formula:
C9H16O3
Molecular weight:
172.22
SMILES notation:
CCCCOC(=O)CCC(=O)C
InChl:
InChI=1/C9H16O3/c1-3-4-7-12-9(11)6-5-8(2)10/h3-7H2,1-2H3
Structural formula:
Chemical structure

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