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Home > Fluorides > 160383-87-9
160383-87-9 | Urea, N-(2-hydroxy-6-nitrophenyl)-N'-[3-(trifluoromethyl)phenyl]-
CAS No: 160383-87-9 Catalog No: AG001RVZ MDL No:
Product Description
Catalog Number:
AG001RVZ
Chemical Name:
Urea, N-(2-hydroxy-6-nitrophenyl)-N'-[3-(trifluoromethyl)phenyl]-
CAS Number:
160383-87-9
Molecular Formula:
C14H10F3N3O4
Molecular Weight:
341.2421
IUPAC Name:
1-(2-hydroxy-6-nitrophenyl)-3-[3-(trifluoromethyl)phenyl]urea
InChI:
InChI=1S/C14H10F3N3O4/c15-14(16,17)8-3-1-4-9(7-8)18-13(22)19-12-10(20(23)24)5-2-6-11(12)21/h1-7,21H,(H2,18,19,22)
InChI Key:
ULOBWFQFTPJMGJ-UHFFFAOYSA-N
SMILES:
O=C(Nc1c(O)cccc1[N+](=O)[O-])Nc1cccc(c1)C(F)(F)F
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
341.062g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
341.246g/mol
Monoisotopic Mass:
341.062g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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