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86781-55-7 | Urea, N,N-dibutyl-N'-(3-methoxyphenyl)-
CAS No: 86781-55-7 Catalog No: AG004N32 MDL No:
Product Description
Catalog Number:
AG004N32
Chemical Name:
Urea, N,N-dibutyl-N'-(3-methoxyphenyl)-
CAS Number:
86781-55-7
Molecular Formula:
C16H26N2O2
Molecular Weight:
278.3898
IUPAC Name:
1,1-dibutyl-3-(3-methoxyphenyl)urea
InChI:
InChI=1S/C16H26N2O2/c1-4-6-11-18(12-7-5-2)16(19)17-14-9-8-10-15(13-14)20-3/h8-10,13H,4-7,11-12H2,1-3H3,(H,17,19)
InChI Key:
WAJNLXRVSDCMLN-UHFFFAOYSA-N
SMILES:
CCCCN(C(=O)Nc1cccc(c1)OC)CCCC
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.199g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.396g/mol
Monoisotopic Mass:
278.199g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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