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137522-83-9 | Acetonitrile, 2-[(4,6-di-4-morpholinyl-1,3,5-triazin-2-yl)oxy]-
CAS No: 137522-83-9 Catalog No: AG0013GW MDL No:
Product Description
Catalog Number:
AG0013GW
Chemical Name:
Acetonitrile, 2-[(4,6-di-4-morpholinyl-1,3,5-triazin-2-yl)oxy]-
CAS Number:
137522-83-9
Molecular Formula:
C13H18N6O3
Molecular Weight:
306.3204
IUPAC Name:
2-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)oxy]acetonitrile
InChI:
InChI=1S/C13H18N6O3/c14-1-6-22-13-16-11(18-2-7-20-8-3-18)15-12(17-13)19-4-9-21-10-5-19/h2-10H2
InChI Key:
ZDWKNJMIIQMADI-UHFFFAOYSA-N
SMILES:
N#CCOc1nc(nc(n1)N1CCOCC1)N1CCOCC1
Properties
Complexity:
365
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.144g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
306.326g/mol
Monoisotopic Mass:
306.144g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
96.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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