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89013-38-7 | Isoxazole, 4-[(4-ethoxyphenyl)azo]-3,5-diphenyl-
CAS No: 89013-38-7 Catalog No: AG0044DW MDL No:
Product Description
Catalog Number:
AG0044DW
Chemical Name:
Isoxazole, 4-[(4-ethoxyphenyl)azo]-3,5-diphenyl-
CAS Number:
89013-38-7
Molecular Formula:
C23H19N3O2
Molecular Weight:
369.4159
IUPAC Name:
(3,5-diphenyl-1,2-oxazol-4-yl)-(4-ethoxyphenyl)diazene
InChI:
InChI=1S/C23H19N3O2/c1-2-27-20-15-13-19(14-16-20)24-25-22-21(17-9-5-3-6-10-17)26-28-23(22)18-11-7-4-8-12-18/h3-16H,2H2,1H3
InChI Key:
ZVQGCGVTZMRNFR-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)N=Nc1c(onc1c1ccccc1)c1ccccc1
Properties
Complexity:
480
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
369.148g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
369.424g/mol
Monoisotopic Mass:
369.148g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
60A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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