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126890-72-0

126890-72-0 | 1-Propanamine, 3-[2-[2-[(2-heptylundecyl)oxy]ethoxy]ethoxy]-

CAS No: 126890-72-0 Catalog No: AG000TGE MDL No:

Product Description

Catalog Number:
AG000TGE
Chemical Name:
1-Propanamine, 3-[2-[2-[(2-heptylundecyl)oxy]ethoxy]ethoxy]-
CAS Number:
126890-72-0
Molecular Formula:
C25H53NO3
Molecular Weight:
415.6932
IUPAC Name:
3-[2-[2-(2-heptylundecoxy)ethoxy]ethoxy]propan-1-amine
InChI:
InChI=1S/C25H53NO3/c1-3-5-7-9-10-12-14-17-25(16-13-11-8-6-4-2)24-29-23-22-28-21-20-27-19-15-18-26/h25H,3-24,26H2,1-2H3
InChI Key:
JEIQHFDFIILMCG-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC(COCCOCCOCCCN)CCCCCCC

Properties

Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
415.403g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
415.703g/mol
Monoisotopic Mass:
415.403g/mol
Rotatable Bond Count:
25  
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
7.7  

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