AG006XAV

Name: Methyl 2-acetyl-3-oxobutanoate
Brand: Angene Chemical
SKU: AG006XAV

4619-66-3 | Methyl 2-acetyl-3-oxobutanoate

AG006XAV

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CAS Number	4619-66-3
Catalog Number	AG006XAV(AGN-PC-0JKFGV)
Chemical Name	Methyl 2-acetyl-3-oxobutanoate
EC Number	225-031-9
IUPAC Name	methyl 2-acetyl-3-oxobutanoate
InChI	InChI=1S/C7H10O4/c1-4(8)6(5(2)9)7(10)11-3/h6H,1-3H3
InChI Key	UHCPCQYUMVLUKU-UHFFFAOYSA-N
MDL Number	MFCD00042938
Molecular Formula	C7H10O4
Molecular Weight	158.1519
SMILES	COC(C(C(C)=O)C(C)=O)=O
UNII	ULU5MKD9FL
Synonyms	Methyl 2-acetyl-3-oxobutanoate, 4619-66-3, Methyl diacetoacetate, Methyl 2-acetylacetoacetate, Methyl diacetylacetate, UNII-ULU5MKD9FL, ULU5MKD9FL, EINECS 225-031-9, BRN 1706278, Methylester kyseliny diacetoctove [Czech], 2-acetyl-3-oxo-butyric acid methyl ester, ACETOACETIC ACID, 2-ACETYL-, METHYL ESTER, Methylester kyseliny diacetoctove, Butanoic acid, 2-acetyl-3-oxo-, methyl ester, AC1L2GW6, 4-03-00-01780 (Beilstein Handbook Reference), SCHEMBL932950, CTK4I9226, DTXSID80196753, 2-Acetyl-3-oxobutanoic acid methyl, ZINC97125356, AKOS004907955, NE10985, LS-13045, Butanoic acid, 2-acetyl-3-oxo-, methyl ester (9CI), Methyl, C7H10O4, CID20736, C7-H10-O4,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	158.058g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	158.153g/mol
Monoisotopic Mass	158.058g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	60.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited