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140939-55-5

140939-55-5 | Pentacosanamide, 25-hydroxy-N,N-diundecyl-

CAS No: 140939-55-5 Catalog No: AG001FNF MDL No:

Product Description

Catalog Number:
AG001FNF
Chemical Name:
Pentacosanamide, 25-hydroxy-N,N-diundecyl-
CAS Number:
140939-55-5
Molecular Formula:
C47H95NO2
Molecular Weight:
706.2627
IUPAC Name:
25-hydroxy-N,N-di(undecyl)pentacosanamide
InChI:
InChI=1S/C47H95NO2/c1-3-5-7-9-11-28-32-36-40-44-48(45-41-37-33-29-12-10-8-6-4-2)47(50)43-39-35-31-27-25-23-21-19-17-15-13-14-16-18-20-22-24-26-30-34-38-42-46-49/h49H,3-46H2,1-2H3
InChI Key:
BHYIHTKHPOSLEI-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCN(C(=O)CCCCCCCCCCCCCCCCCCCCCCCCO)CCCCCCCCCCC

Properties

Complexity:
600  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
705.736g/mol
Formal Charge:
0
Heavy Atom Count:
50  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
706.282g/mol
Monoisotopic Mass:
705.736g/mol
Rotatable Bond Count:
44  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
20.4  

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