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102253-20-3 | Urea, N-(4-hydroxyphenyl)-N'-octadecyl-
CAS No: 102253-20-3 Catalog No: AG00071K MDL No:
Product Description
Catalog Number:
AG00071K
Chemical Name:
Urea, N-(4-hydroxyphenyl)-N'-octadecyl-
CAS Number:
102253-20-3
Molecular Formula:
C25H44N2O2
Molecular Weight:
404.6291
IUPAC Name:
1-(4-hydroxyphenyl)-3-octadecylurea
InChI:
InChI=1S/C25H44N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-26-25(29)27-23-18-20-24(28)21-19-23/h18-21,28H,2-17,22H2,1H3,(H2,26,27,29)
InChI Key:
GSJKWMTVUQNZHT-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCNC(=O)Nc1ccc(cc1)O
Properties
Complexity:
368
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
404.34g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
404.639g/mol
Monoisotopic Mass:
404.34g/mol
Rotatable Bond Count:
18
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.4
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