Methanone, (2-butyl-3-benzofuranyl)(4-hydroxy-3,5-diiodophenyl)-


Chemical Name: Methanone, (2-butyl-3-benzofuranyl)(4-hydroxy-3,5-diiodophenyl)-
CAS Number: 1951-26-4
Product Number: AG007RDO(AGN-PC-0JLBU3)
Synonyms:
MDL No:
Molecular Formula: C19H16I2O3
Molecular Weight: 546.1375

Identification/Properties


Computed Properties
Molecular Weight:
546.143g/mol
XLogP3:
6.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
545.919g/mol
Monoisotopic Mass:
545.919g/mol
Topological Polar Surface Area:
50.4A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
432
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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