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Reference substances

Reference substances

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General information

Inventory

EC number:
204-649-2
EC name:
4-oxovaleric acid
CAS number:
123-76-2

No inventory information available

Reference substance information

IUPAC name:
4-oxopentanoic acid
Synonyms
Names:
4-oxo-pentanoic_acid
Pentanoic acid, 4-oxo-
Identifier:
CAS number
123-76-2
Identifier:
EC name
4-oxovaleric acid
Identifier:
EC number
204-649-2
Identifier:
IUPAC name
4-Oxopentanoic acid
Identifier:
IUPAC name
4-oxo pentanoic acid
Identifier:
common name
Levulinic acid
Identifier:
other: SMILES notation
C(CCC(O)=O)(C)=O
Identifier:
other: SMILES notation
O=C(O)CCC(=O)C
4-oxopentanoic acid

CAS information

CAS number:
123-76-2

Molecular and structural information

Molecular formula:
C5H8O3
Molecular weight:
116.12
SMILES notation:
CC(=O)CCC(=O)O
InChl:
InChI=1/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)
Structural formula:
Chemical structure