bis[(3,5-dibromo-2-hydroxyphenyl)methyl] butanedioate


Chemical Name: bis[(3,5-dibromo-2-hydroxyphenyl)methyl] butanedioate
CAS Number: 71337-52-5
Product Number: AG005JQ0(AGN-PC-0IKWXR)
Synonyms:
MDL No:
Molecular Formula: C18H14Br4O6
Molecular Weight: 645.9162

Identification/Properties


Computed Properties
Molecular Weight:
645.92g/mol
XLogP3:
4.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
9
Exact Mass:
645.748g/mol
Monoisotopic Mass:
641.752g/mol
Topological Polar Surface Area:
93.1A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
490
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


NMR Spectrum


Other Analytical Data


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