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139702-04-8

139702-04-8 | Phenol, 2,2'-(2,5,8,11-tetraazadodecane-1,12-diyl)bis-

CAS No: 139702-04-8 Catalog No: AG001BJ7 MDL No:

Product Description

Catalog Number:
AG001BJ7
Chemical Name:
Phenol, 2,2'-(2,5,8,11-tetraazadodecane-1,12-diyl)bis-
CAS Number:
139702-04-8
Molecular Formula:
C20H30N4O2
Molecular Weight:
358.4778
IUPAC Name:
2-[[2-[2-[2-[(2-hydroxyphenyl)methylamino]ethylamino]ethylamino]ethylamino]methyl]phenol
InChI:
InChI=1S/C20H30N4O2/c25-19-7-3-1-5-17(19)15-23-13-11-21-9-10-22-12-14-24-16-18-6-2-4-8-20(18)26/h1-8,21-26H,9-16H2
InChI Key:
LJFXVUWDLRKQAR-UHFFFAOYSA-N
SMILES:
Oc1ccccc1CNCCNCCNCCNCc1ccccc1O

Properties

Complexity:
314  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.237g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
358.486g/mol
Monoisotopic Mass:
358.237g/mol
Rotatable Bond Count:
13  
Topological Polar Surface Area:
88.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

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