Name: Name:Ethyl acetoacetate-1,2,3,4-13C4
Brand: Angene
SKU: AG004RZU
Rating: 90 (10 reviews)

Ethyl acetoacetate-1,2,3,4-13C4

CAS No.:

84508-55-4

Catalog Number:

AG004RZU

Molecular Formula:

C6H10O3

Molecular Weight:

134.1124

Catalog Number:

AG004RZU

Chemical Name:

Ethyl acetoacetate-1,2,3,4-13C4

CAS Number:

84508-55-4

Molecular Formula:

C6H10O3

Molecular Weight:

134.1124

MDL Number:

MFCD00083958

IUPAC Name:

ethyl 3-oxo(1,2,3,4-13C4)butanoate

InChI:

InChI=1S/C6H10O3/c1-3-9-6(8)4-5(2)7/h3-4H2,1-2H3/i2+1,4+1,5+1,6+1

InChI Key:

XYIBRDXRRQCHLP-XMUWKQMQSA-N

SMILES:

CCO[13C](=O)[13CH2][13C](=O)[13CH3]

Complexity:

118

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

134.076g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

134.112g/mol

Monoisotopic Mass:

134.076g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

43.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.2