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290298-96-3 | Phenol, 5-[2-(acetyloxy)ethoxy]-2-(4,6-diphenyl-1,3,5-triazin-2-yl)-
CAS No: 290298-96-3 Catalog No: AG002V99 MDL No:
Product Description
Catalog Number:
AG002V99
Chemical Name:
Phenol, 5-[2-(acetyloxy)ethoxy]-2-(4,6-diphenyl-1,3,5-triazin-2-yl)-
CAS Number:
290298-96-3
Molecular Formula:
C25H21N3O4
Molecular Weight:
427.4519
IUPAC Name:
2-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-hydroxyphenoxy]ethyl acetate
InChI:
InChI=1S/C25H21N3O4/c1-17(29)31-14-15-32-20-12-13-21(22(30)16-20)25-27-23(18-8-4-2-5-9-18)26-24(28-25)19-10-6-3-7-11-19/h2-13,16,30H,14-15H2,1H3
InChI Key:
WJSQEQUASMHJTP-UHFFFAOYSA-N
SMILES:
CC(=O)OCCOc1ccc(c(c1)O)c1nc(nc(n1)c1ccccc1)c1ccccc1
Properties
Complexity:
554
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
427.153g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
427.46g/mol
Monoisotopic Mass:
427.153g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
94.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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