Benzenepropanoic acid, 4-(4-hydroxyphenoxy)-3,5-diiodo-


Chemical Name: Benzenepropanoic acid, 4-(4-hydroxyphenoxy)-3,5-diiodo-
CAS Number: 1158-10-7
Product Number: AG000GWD(AGN-PC-0JPMR8)
Synonyms:
MDL No:
Molecular Formula: C15H12I2O4
Molecular Weight: 510.0623

Identification/Properties


Computed Properties
Molecular Weight:
510.066g/mol
XLogP3:
4.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
509.883g/mol
Monoisotopic Mass:
509.883g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
333
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

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NMR Spectrum


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