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21260-50-4 | Urea, N-butyl-N'-(4-nitrophenyl)-
CAS No: 21260-50-4 Catalog No: AG00I430 MDL No:
Product Description
Catalog Number:
AG00I430
Chemical Name:
Urea, N-butyl-N'-(4-nitrophenyl)-
CAS Number:
21260-50-4
IUPAC Name:
1-butyl-3-(4-nitrophenyl)urea
InChI:
InChI=1S/C11H15N3O3/c1-2-3-8-12-11(15)13-9-4-6-10(7-5-9)14(16)17/h4-7H,2-3,8H2,1H3,(H2,12,13,15)
InChI Key:
NDTSJJRJPBJYET-UHFFFAOYSA-N
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.111g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
237.259g/mol
Monoisotopic Mass:
237.111g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
87A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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