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10138-71-3 | Ethanol, 2,2'-[[2-[(2-aminoethyl)amino]ethyl]imino]bis- (9CI)
CAS No: 10138-71-3 Catalog No: AG0004C2 MDL No:
Product Description
Catalog Number:
AG0004C2
Chemical Name:
Ethanol, 2,2'-[[2-[(2-aminoethyl)amino]ethyl]imino]bis- (9CI)
CAS Number:
10138-71-3
Molecular Formula:
C8H21N3O2
Molecular Weight:
191.2712
IUPAC Name:
2-[2-(2-aminoethylamino)ethyl-(2-hydroxyethyl)amino]ethanol
InChI:
InChI=1S/C8H21N3O2/c9-1-2-10-3-4-11(5-7-12)6-8-13/h10,12-13H,1-9H2
InChI Key:
MYQSUSHLWUPYLB-UHFFFAOYSA-N
SMILES:
NCCNCCN(CCO)CCO
Properties
Complexity:
97.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.163g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
191.275g/mol
Monoisotopic Mass:
191.163g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
81.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.5
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