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Home > Nitro Compounds > 1858256-68-4
1858256-68-4 | 1-(3-Nitrophenyl)-3-phenyl-1H-pyrazol-5-ol
CAS No: 1858256-68-4 Catalog No: AG00I1P8 MDL No:
Product Description
Catalog Number:
AG00I1P8
Chemical Name:
1-(3-Nitrophenyl)-3-phenyl-1H-pyrazol-5-ol
CAS Number:
1858256-68-4
IUPAC Name:
2-(3-nitrophenyl)-5-phenyl-1H-pyrazol-3-one
InChI:
InChI=1S/C15H11N3O3/c19-15-10-14(11-5-2-1-3-6-11)16-17(15)12-7-4-8-13(9-12)18(20)21/h1-10,16H
InChI Key:
BJJDRCUPDUZNRC-UHFFFAOYSA-N
Properties
Complexity:
452
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.08g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.271g/mol
Monoisotopic Mass:
281.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
78.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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