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Home > Boronic Acids > 245737-33-1
245737-33-1 | (Nitrilotri-4,1-phenylene)trisboronic acid
CAS No: 245737-33-1 Catalog No: AG00BDQX MDL No:
Product Description
Catalog Number:
AG00BDQX
Chemical Name:
(Nitrilotri-4,1-phenylene)trisboronic acid
CAS Number:
245737-33-1
IUPAC Name:
[4-(4-borono-N-(4-boronophenyl)anilino)phenyl]boronic acid
InChI:
InChI=1S/C18H18B3NO6/c23-19(24)13-1-7-16(8-2-13)22(17-9-3-14(4-10-17)20(25)26)18-11-5-15(6-12-18)21(27)28/h1-12,23-28H
InChI Key:
OFNCRKBEBXOCAU-UHFFFAOYSA-N
Properties
Complexity:
396
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
377.141g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
376.773g/mol
Monoisotopic Mass:
377.141g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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