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876896-90-1 | Nonanamide, 2-iodo-N-[2-(4-methylphenyl)ethyl]-
CAS No: 876896-90-1 Catalog No: AG004NSB MDL No:
Product Description
Catalog Number:
AG004NSB
Chemical Name:
Nonanamide, 2-iodo-N-[2-(4-methylphenyl)ethyl]-
CAS Number:
876896-90-1
Molecular Formula:
C18H28INO
Molecular Weight:
401.3255
IUPAC Name:
2-iodo-N-[2-(4-methylphenyl)ethyl]nonanamide
InChI:
InChI=1S/C18H28INO/c1-3-4-5-6-7-8-17(19)18(21)20-14-13-16-11-9-15(2)10-12-16/h9-12,17H,3-8,13-14H2,1-2H3,(H,20,21)
InChI Key:
HCDVANRJIZPDIO-UHFFFAOYSA-N
SMILES:
CCCCCCCC(C(=O)NCCc1ccc(cc1)C)I
Properties
Complexity:
274
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
401.122g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
401.332g/mol
Monoisotopic Mass:
401.122g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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