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Home > Boronic Acids > 16396-62-6
16396-62-6 | Boroxin, 2,4,6-tris(4-ethenylphenyl)-
CAS No: 16396-62-6 Catalog No: AG001UKD MDL No:
Product Description
Catalog Number:
AG001UKD
Chemical Name:
Boroxin, 2,4,6-tris(4-ethenylphenyl)-
CAS Number:
16396-62-6
Molecular Formula:
C24H21B3O3
Molecular Weight:
389.8547
IUPAC Name:
2,4,6-tris(4-ethenylphenyl)-1,3,5,2,4,6-trioxatriborinane
InChI:
InChI=1S/C24H21B3O3/c1-4-19-7-13-22(14-8-19)25-28-26(23-15-9-20(5-2)10-16-23)30-27(29-25)24-17-11-21(6-3)12-18-24/h4-18H,1-3H2
InChI Key:
JTGSJFSOAAJGPP-UHFFFAOYSA-N
SMILES:
C=Cc1ccc(cc1)B1OB(OB(O1)c1ccc(cc1)C=C)c1ccc(cc1)C=C
Properties
Complexity:
483
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
390.177g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
389.859g/mol
Monoisotopic Mass:
390.177g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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