Cas no 62089-28-5 (1H-Pyrazole, 5-(4-nitrophenyl)-1-phenyl-)
62089-28-5 structure
Product Name:1H-Pyrazole, 5-(4-nitrophenyl)-1-phenyl-
CAS No:62089-28-5
MF:C15H11N3O2
MW:265.266742944717
CID:458617
PubChem ID:13287219
Update Time:2025-04-19
1H-Pyrazole, 5-(4-nitrophenyl)-1-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole, 5-(4-nitrophenyl)-1-phenyl-
- 5-(4-nitrophenyl)-1-phenylpyrazole
- 62089-28-5
- SCHEMBL15559842
- YZWANVMVDZKGCA-UHFFFAOYSA-N
- 5-(4-Nitrophenyl)-1-phenyl-1H-pyrazole
- 5-(4-nitro-phenyl)-1-phenyl-1H-pyrazole
- DTXSID30534823
-
- Inchi： 1S/C15H11N3O2/c19-18(20)14-8-6-12(7-9-14)15-10-11-16-17(15)13-4-2-1-3-5-13/h1-11H
- InChI Key： YZWANVMVDZKGCA-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=CC(=CC=1)C1=CC=NN1C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 265.08523
- Monoisotopic Mass: 265.085126602g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 331
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.4
- Topological Polar Surface Area: 63.6?2
Experimental Properties
- PSA: 60.96
1H-Pyrazole, 5-(4-nitrophenyl)-1-phenyl- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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