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113613-35-7 | 2-Butanone, 3-iodo-3-methyl-
CAS No: 113613-35-7 Catalog No: AG009MDI MDL No:
Product Description
Catalog Number:
AG009MDI
Chemical Name:
2-Butanone, 3-iodo-3-methyl-
CAS Number:
113613-35-7
IUPAC Name:
3-iodo-3-methylbutan-2-one
InChI:
InChI=1S/C5H9IO/c1-4(7)5(2,3)6/h1-3H3
InChI Key:
AMAJPSBXXMYTFM-UHFFFAOYSA-N
Properties
Complexity:
86.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.97g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.03g/mol
Monoisotopic Mass:
211.97g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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