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71641-61-7

71641-61-7 | Methanone, bis(2-iodo-4-nitrophenyl)-

CAS No: 71641-61-7 Catalog No: AG005RF7 MDL No:

Product Description

Catalog Number:
AG005RF7
Chemical Name:
Methanone, bis(2-iodo-4-nitrophenyl)-
CAS Number:
71641-61-7
Molecular Formula:
C13H6I2N2O5
Molecular Weight:
524.0061
IUPAC Name:
bis(2-iodo-4-nitrophenyl)methanone
InChI:
InChI=1S/C13H6I2N2O5/c14-11-5-7(16(19)20)1-3-9(11)13(18)10-4-2-8(17(21)22)6-12(10)15/h1-6H
InChI Key:
ZVEXDFBSVFNCNM-UHFFFAOYSA-N
SMILES:
Ic1cc(ccc1C(=O)c1ccc(cc1I)[N+](=O)[O-])[N+](=O)[O-]

Properties

Complexity:
424  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
523.837g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
524.009g/mol
Monoisotopic Mass:
523.837g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
109A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  

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