ethyl 4-oxobutanoate, 95%

Name: ethyl 4-oxobutanoate
Brand: Chempure

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CAS Number

10138-10-0

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About this item

IUPAC name	ethyl 4-oxobutanoate
inchi	InChI=1S/C6H10O3/c1-2-9-6(8)4-3-5-7/h5H,2-4H2,1H3
inchi key	QFMPHCGACBODIJ-UHFFFAOYSA-N
molecular formula	C6H10O3
synonyms	ethyl 4-oxobutanoate 10138-10-0 ethyl 4-oxobutyrate Butanoic acid, 4-oxo-, ethyl ester ethyl 3-formylpropionate
Compound Description	Ethyl 4-oxobutanoate is a carboxylic ester obtained by the formal condensation of the carboxy group of succinic semialdehyde with ethanol. It has a role as a metabolite. It is an aldehyde and a carboxylic ester. It is functionally related to a succinic semialdehyde and an ethanol.

Computed Properties

Molecular Weight:	130.14 g/mol
XLogP3:	-0.1
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	5
Exact Mass:	130.062994177 g/mol
Monoisotopic Mass:	130.062994177 g/mol
Topological Polar Surface Area:	43.4 Å²
Heavy Atom Count:	9
Formal Charge:	0
Complexity:	98.5
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

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Product No: AX5374

ethyl 4-oxobutanoate, 95%

Product No: AX5374

About this item

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Product No: AX5374

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CHEMICAL AND PHYSICAL PROPERTIES

Require a Sample Certificate of Analysis (COA) ?