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89469-86-3 | 2-Propanol, 1,1'-[1,6-hexanediylbis(oxy)]bis[3-amino-
CAS No: 89469-86-3 Catalog No: AG0042JA MDL No:
Product Description
Catalog Number:
AG0042JA
Chemical Name:
2-Propanol, 1,1'-[1,6-hexanediylbis(oxy)]bis[3-amino-
CAS Number:
89469-86-3
Molecular Formula:
C12H28N2O4
Molecular Weight:
264.3617
IUPAC Name:
1-amino-3-[6-(3-amino-2-hydroxypropoxy)hexoxy]propan-2-ol
InChI:
InChI=1S/C12H28N2O4/c13-7-11(15)9-17-5-3-1-2-4-6-18-10-12(16)8-14/h11-12,15-16H,1-10,13-14H2
InChI Key:
DQRDIWABAZQAFH-UHFFFAOYSA-N
SMILES:
NCC(COCCCCCCOCC(CN)O)O
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.205g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
264.366g/mol
Monoisotopic Mass:
264.205g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.8
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