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155647-70-4 | Benzenamine, 3,3',3''-[1,3,5-triazine-2,4,6-triyltris(oxy)]tris[N,N-diethyl- (9CI)
CAS No: 155647-70-4 Catalog No: AG001O3G MDL No:
Product Description
Catalog Number:
AG001O3G
Chemical Name:
Benzenamine, 3,3',3''-[1,3,5-triazine-2,4,6-triyltris(oxy)]tris[N,N-diethyl- (9CI)
CAS Number:
155647-70-4
Molecular Formula:
C33H42N6O3
Molecular Weight:
570.7250
IUPAC Name:
3-[[4,6-bis[3-(diethylamino)phenoxy]-1,3,5-triazin-2-yl]oxy]-N,N-diethylaniline
InChI:
InChI=1S/C33H42N6O3/c1-7-37(8-2)25-16-13-19-28(22-25)40-31-34-32(41-29-20-14-17-26(23-29)38(9-3)10-4)36-33(35-31)42-30-21-15-18-27(24-30)39(11-5)12-6/h13-24H,7-12H2,1-6H3
InChI Key:
ZKXDNWIKMYGUEL-UHFFFAOYSA-N
SMILES:
CCN(c1cccc(c1)Oc1nc(Oc2cccc(c2)N(CC)CC)nc(n1)Oc1cccc(c1)N(CC)CC)CC
Properties
Complexity:
630
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
570.332g/mol
Formal Charge:
0
Heavy Atom Count:
42
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
570.738g/mol
Monoisotopic Mass:
570.332g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.1
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