2-Pentanone, 3-mercapto-


Chemical Name: 2-Pentanone, 3-mercapto-
CAS Number: 67633-97-0
Product Number: AG003JMB(AGN-PC-0JL4WT)
Synonyms:
MDL No: MFCD02093290
Molecular Formula: C5H10OS
Molecular Weight: 118.1973

Identification/Properties


Properties
Storage:
2-8℃;Inert atmosphere;
Computed Properties
Molecular Weight:
118.194g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
118.045g/mol
Monoisotopic Mass:
118.045g/mol
Topological Polar Surface Area:
18.1A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
70.5
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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