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16269-01-5 | Methanol, 1-[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]methylamino]-
CAS No: 16269-01-5 Catalog No: AG001TBK MDL No:
Product Description
Catalog Number:
AG001TBK
Chemical Name:
Methanol, 1-[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]methylamino]-
CAS Number:
16269-01-5
Molecular Formula:
C9H18N6O
Molecular Weight:
226.2788
IUPAC Name:
[[4,6-bis(dimethylamino)-1,3,5-triazin-2-yl]-methylamino]methanol
InChI:
InChI=1S/C9H18N6O/c1-13(2)7-10-8(14(3)4)12-9(11-7)15(5)6-16/h16H,6H2,1-5H3
InChI Key:
GELQGNSEMRPIQJ-UHFFFAOYSA-N
SMILES:
OCNCc1nc(nc(n1)N(C)C)N(C)C
UNII:
S85C8W1EWW
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.154g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.284g/mol
Monoisotopic Mass:
226.154g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
68.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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