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124232-76-4 | 1,2-Ethanediamine, N1,N1,N2,N2-tetrahexadecyl-
CAS No: 124232-76-4 Catalog No: AG000LPT MDL No:
Product Description
Catalog Number:
AG000LPT
Chemical Name:
1,2-Ethanediamine, N1,N1,N2,N2-tetrahexadecyl-
CAS Number:
124232-76-4
Molecular Formula:
C66H136N2
Molecular Weight:
957.7994
IUPAC Name:
N,N,N',N'-tetrahexadecylethane-1,2-diamine
InChI:
InChI=1S/C66H136N2/c1-5-9-13-17-21-25-29-33-37-41-45-49-53-57-61-67(62-58-54-50-46-42-38-34-30-26-22-18-14-10-6-2)65-66-68(63-59-55-51-47-43-39-35-31-27-23-19-15-11-7-3)64-60-56-52-48-44-40-36-32-28-24-20-16-12-8-4/h5-66H2,1-4H3
InChI Key:
WKGHJBXTMFXUNA-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCN(CCCCCCCCCCCCCCCC)CCN(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC
Properties
Complexity:
709
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
957.07g/mol
Formal Charge:
0
Heavy Atom Count:
68
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
957.828g/mol
Monoisotopic Mass:
957.07g/mol
Rotatable Bond Count:
63
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
31.3
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