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31053-10-8 | 4-Iodocyclohexanone
CAS No: 31053-10-8 Catalog No: AG01E43W MDL No:
Product Description
Catalog Number:
AG01E43W
Chemical Name:
4-Iodocyclohexanone
CAS Number:
31053-10-8
IUPAC Name:
4-iodocyclohexan-1-one
InChI:
InChI=1S/C6H9IO/c7-5-1-3-6(8)4-2-5/h5H,1-4H2
InChI Key:
MHNOEIBCMLBZKN-UHFFFAOYSA-N
Properties
Complexity:
90.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.97g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.041g/mol
Monoisotopic Mass:
223.97g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Literature
| Title | Journal |
|---|---|
| Asymmetric Baeyer-Villiger oxidations of 4-mono- and 4,4-disubstituted cyclohexanones by whole cells of engineered Escherichia coli. | The Journal of organic chemistry 20010209 |
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