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144106-04-7 | Urea, N,N-dioctyl-N'-phenyl-
CAS No: 144106-04-7 Catalog No: AG001IYN MDL No:
Product Description
Catalog Number:
AG001IYN
Chemical Name:
Urea, N,N-dioctyl-N'-phenyl-
CAS Number:
144106-04-7
Molecular Formula:
C23H40N2O
Molecular Weight:
360.5765
IUPAC Name:
1,1-dioctyl-3-phenylurea
InChI:
InChI=1S/C23H40N2O/c1-3-5-7-9-11-16-20-25(21-17-12-10-8-6-4-2)23(26)24-22-18-14-13-15-19-22/h13-15,18-19H,3-12,16-17,20-21H2,1-2H3,(H,24,26)
InChI Key:
VYQLOIXTIDYOKA-UHFFFAOYSA-N
SMILES:
CCCCCCCCN(C(=O)Nc1ccccc1)CCCCCCCC
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.314g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
360.586g/mol
Monoisotopic Mass:
360.314g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.9
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