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1216468-84-6 | 4-Iodonitrobenzene-13C6
CAS No: 1216468-84-6 Catalog No: AG01E06P MDL No:
Product Description
Catalog Number:
AG01E06P
Chemical Name:
4-Iodonitrobenzene-13C6
CAS Number:
1216468-84-6
IUPAC Name:
1-iodo-4-nitro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene
InChI:
InChI=1S/C6H4INO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H/i1+1,2+1,3+1,4+1,5+1,6+1
InChI Key:
SCCCFNJTCDSLCY-IDEBNGHGSA-N
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.949g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
6
Molecular Weight:
254.962g/mol
Monoisotopic Mass:
254.949g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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