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Home > Nitro Compounds > 62160-33-2
62160-33-2 | 1H-Pyrazole, 1-(4-nitrophenyl)-5-phenyl-
CAS No: 62160-33-2 Catalog No: AG00IAZJ MDL No:MFCD20275398
Product Description
Catalog Number:
AG00IAZJ
Chemical Name:
1H-Pyrazole, 1-(4-nitrophenyl)-5-phenyl-
CAS Number:
62160-33-2
Molecular Formula:
C15H11N3O2
Molecular Weight:
265.2667
MDL Number:
MFCD20275398
IUPAC Name:
1-(4-nitrophenyl)-5-phenylpyrazole
InChI:
InChI=1S/C15H11N3O2/c19-18(20)14-8-6-13(7-9-14)17-15(10-11-16-17)12-4-2-1-3-5-12/h1-11H
InChI Key:
XZHRORCXZCBQPL-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)n1nccc1c1ccccc1
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.085g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.272g/mol
Monoisotopic Mass:
265.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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