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89806-55-3 | Urea, N-methyl-N'-octadecyl-
CAS No: 89806-55-3 Catalog No: AG003Z04 MDL No:
Product Description
Catalog Number:
AG003Z04
Chemical Name:
Urea, N-methyl-N'-octadecyl-
CAS Number:
89806-55-3
Molecular Formula:
C20H42N2O
Molecular Weight:
326.5603
IUPAC Name:
1-methyl-3-octadecylurea
InChI:
InChI=1S/C20H42N2O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20(23)21-2/h3-19H2,1-2H3,(H2,21,22,23)
InChI Key:
LSQKEPYQHJIHMG-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCNC(=O)NC
Properties
Complexity:
244
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.33g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
326.569g/mol
Monoisotopic Mass:
326.33g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.2
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