Home Other Building Blocks ACETONE (13C3)

ACETONE (13C3)

CAS No.:
93628-01-4
Catalog Number:
AG00GR7O
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00GR7O
Chemical Name:
ACETONE (13C3)
CAS Number:
93628-01-4
MDL Number:
MFCD00083865
IUPAC Name:
(1,2,3-13C3)propan-2-one
InChI:
InChI=1S/C3H6O/c1-3(2)4/h1-2H3/i1+1,2+1,3+1
InChI Key:
CSCPPACGZOOCGX-VMIGTVKRSA-N
Properties
Complexity:
26.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
61.052g/mol
Formal Charge:
0
Heavy Atom Count:
4  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
3  
Molecular Weight:
61.057g/mol
Monoisotopic Mass:
61.052g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Literature
Title Journal
Determination of ketone bodies in blood by headspace gas chromatography-mass spectrometry. Journal of analytical toxicology 20101101
Properties