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201544-02-7 | Benzenamine, 4,4',4''-(1,3,5-triazine-2,4,6-triyl)tris[N,N-diethyl-
CAS No: 201544-02-7 Catalog No: AG002DH0 MDL No:
Product Description
Catalog Number:
AG002DH0
Chemical Name:
Benzenamine, 4,4',4''-(1,3,5-triazine-2,4,6-triyl)tris[N,N-diethyl-
CAS Number:
201544-02-7
Molecular Formula:
C33H42N6
Molecular Weight:
522.7268
IUPAC Name:
4-[4,6-bis[4-(diethylamino)phenyl]-1,3,5-triazin-2-yl]-N,N-diethylaniline
InChI:
InChI=1S/C33H42N6/c1-7-37(8-2)28-19-13-25(14-20-28)31-34-32(26-15-21-29(22-16-26)38(9-3)10-4)36-33(35-31)27-17-23-30(24-18-27)39(11-5)12-6/h13-24H,7-12H2,1-6H3
InChI Key:
HGVKWFBPCQHLML-UHFFFAOYSA-N
SMILES:
CCN(c1ccc(cc1)c1nc(nc(n1)c1ccc(cc1)N(CC)CC)c1ccc(cc1)N(CC)CC)CC
Properties
Complexity:
551
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
522.347g/mol
Formal Charge:
0
Heavy Atom Count:
39
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
522.741g/mol
Monoisotopic Mass:
522.347g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.5
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