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16857-97-9 | Morpholine, 4,4',4''-(1,3,5-benzenetriyl)tris-
CAS No: 16857-97-9 Catalog No: AG001Y5J MDL No:
Product Description
Catalog Number:
AG001Y5J
Chemical Name:
Morpholine, 4,4',4''-(1,3,5-benzenetriyl)tris-
CAS Number:
16857-97-9
Molecular Formula:
C18H27N3O3
Molecular Weight:
333.4253
IUPAC Name:
4-(3,5-dimorpholin-4-ylphenyl)morpholine
InChI:
InChI=1S/C18H27N3O3/c1-7-22-8-2-19(1)16-13-17(20-3-9-23-10-4-20)15-18(14-16)21-5-11-24-12-6-21/h13-15H,1-12H2
InChI Key:
QRDSHGHAXXGWNI-UHFFFAOYSA-N
SMILES:
O1CCN(CC1)c1cc(cc(c1)N1CCOCC1)N1CCOCC1
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.205g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.432g/mol
Monoisotopic Mass:
333.205g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Evidence of reversibility in azo-coupling reactions between 1,3,5-tris(N,N-dialkylamino)benzenes and arenediazonium salts. | The Journal of organic chemistry 20071109 |
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