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126583-50-4 | Borazine, 2-(4-ethenylphenyl)-4,6-dimethyl-1,3,5-triphenyl-
CAS No: 126583-50-4 Catalog No: AG000SYP MDL No:
Product Description
Catalog Number:
AG000SYP
Chemical Name:
Borazine, 2-(4-ethenylphenyl)-4,6-dimethyl-1,3,5-triphenyl-
CAS Number:
126583-50-4
Molecular Formula:
C28H28B3N3
Molecular Weight:
438.9750
IUPAC Name:
2-(4-ethenylphenyl)-4,6-dimethyl-1,3,5-triphenyl-1,3,5,2,4,6-triazatriborinane
InChI:
InChI=1S/C28H28B3N3/c1-4-24-20-22-25(23-21-24)31-33(27-16-10-6-11-17-27)29(2)32(26-14-8-5-9-15-26)30(3)34(31)28-18-12-7-13-19-28/h4-23H,1H2,2-3H3
InChI Key:
KVXOSHAMBJZJSC-UHFFFAOYSA-N
SMILES:
C=Cc1ccc(cc1)B1N(c2ccccc2)B(C)N(B(N1c1ccccc1)C)c1ccccc1
Properties
Complexity:
605
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
439.256g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
438.983g/mol
Monoisotopic Mass:
439.256g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
9.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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