1,3-Benzenedicarboxylic acid, 5-borono-


Chemical Name: 1,3-Benzenedicarboxylic acid, 5-borono-
CAS Number: 881302-73-4
Product Number: AG008C7F(AGN-PC-0712PV)
Synonyms:
MDL No:
Molecular Formula: C8H7BO6
Molecular Weight: 209.9486

Identification/Properties


Computed Properties
Molecular Weight:
209.948g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
210.034g/mol
Monoisotopic Mass:
210.034g/mol
Topological Polar Surface Area:
115A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
244
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


Other Analytical Data


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