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Home > Imidazoles > 126115-49-9
126115-49-9 | Octanamide, N-[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl]-
CAS No: 126115-49-9 Catalog No: AG000RNC MDL No:
Product Description
Catalog Number:
AG000RNC
Chemical Name:
Octanamide, N-[2-(2-heptadecyl-4,5-dihydro-1H-imidazol-1-yl)ethyl]-
CAS Number:
126115-49-9
Molecular Formula:
C30H59N3O
Molecular Weight:
477.8090
IUPAC Name:
N-[2-(2-heptadecyl-4,5-dihydroimidazol-1-yl)ethyl]octanamide
InChI:
InChI=1S/C30H59N3O/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-20-21-23-29-31-25-27-33(29)28-26-32-30(34)24-22-19-8-6-4-2/h3-28H2,1-2H3,(H,32,34)
InChI Key:
JNRCVPPSKWWTAS-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCC1=NCCN1CCNC(=O)CCCCCCC
Properties
Complexity:
491
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
477.466g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
477.822g/mol
Monoisotopic Mass:
477.466g/mol
Rotatable Bond Count:
25
Topological Polar Surface Area:
44.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.1
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