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113714-63-9 | Ethanol, 2,2',2''-[(hexahydro-1,3,5-triazine-2,4,6-triyl)triimino]tris- (9CI)
CAS No: 113714-63-9 Catalog No: AG0009FM MDL No:
Product Description
Catalog Number:
AG0009FM
Chemical Name:
Ethanol, 2,2',2''-[(hexahydro-1,3,5-triazine-2,4,6-triyl)triimino]tris- (9CI)
CAS Number:
113714-63-9
Molecular Formula:
C9H24N6O3
Molecular Weight:
264.3253
IUPAC Name:
2-[[4,6-bis(2-hydroxyethylamino)-1,3,5-triazinan-2-yl]amino]ethanol
InChI:
InChI=1S/C9H24N6O3/c16-4-1-10-7-13-8(11-2-5-17)15-9(14-7)12-3-6-18/h7-18H,1-6H2
InChI Key:
KYLNEYNIFBOJGH-UHFFFAOYSA-N
SMILES:
OCCNC1NC(NCCO)NC(N1)NCCO
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.191g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
9
Isotope Atom Count:
0
Molecular Weight:
264.33g/mol
Monoisotopic Mass:
264.191g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.8
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