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159690-33-2 | 1,3,5-Triazine, 2-butyl-2-(1,1-dimethylethyl)-1,2-dihydro-4,6-diphenyl-
CAS No: 159690-33-2 Catalog No: AG001RBD MDL No:
Product Description
Catalog Number:
AG001RBD
Chemical Name:
1,3,5-Triazine, 2-butyl-2-(1,1-dimethylethyl)-1,2-dihydro-4,6-diphenyl-
CAS Number:
159690-33-2
Molecular Formula:
C23H29N3
Molecular Weight:
347.4965
IUPAC Name:
4-butyl-4-tert-butyl-2,6-diphenyl-1H-1,3,5-triazine
InChI:
InChI=1S/C23H29N3/c1-5-6-17-23(22(2,3)4)25-20(18-13-9-7-10-14-18)24-21(26-23)19-15-11-8-12-16-19/h7-16H,5-6,17H2,1-4H3,(H,24,25,26)
InChI Key:
GKDYUVNTKPLZIT-UHFFFAOYSA-N
SMILES:
CCCCC1(NC(=NC(=N1)c1ccccc1)c1ccccc1)C(C)(C)C
Properties
Complexity:
480
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.236g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
347.506g/mol
Monoisotopic Mass:
347.236g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
36.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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