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39495-50-6 | 4-(Hydroxyimino)-3-iodo-2,5-cyclohexadien-1-one
CAS No: 39495-50-6 Catalog No: AG00CYGK MDL No:
Product Description
Catalog Number:
AG00CYGK
Chemical Name:
4-(Hydroxyimino)-3-iodo-2,5-cyclohexadien-1-one
CAS Number:
39495-50-6
IUPAC Name:
3-iodo-4-nitrosophenol
InChI:
InChI=1S/C6H4INO2/c7-5-3-4(9)1-2-6(5)8-10/h1-3,9H
InChI Key:
CCAMOKMWECRXDF-UHFFFAOYSA-N
NSC Number:
239652
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.929g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.007g/mol
Monoisotopic Mass:
248.929g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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