Cas no 88405-34-9 (1H-Pyrazole, 4,5-dihydro-3,5-bis[4-(methylsulfonyl)phenyl]-1-phenyl-)
![1H-Pyrazole, 4,5-dihydro-3,5-bis[4-(methylsulfonyl)phenyl]-1-phenyl- structure](https://ossimg.kuujia.com/scimg/88500/88405-34-9x500.png)
88405-34-9 structure
Product Name:1H-Pyrazole, 4,5-dihydro-3,5-bis[4-(methylsulfonyl)phenyl]-1-phenyl-
CAS No:88405-34-9
MF:C23H22N2O4S2
MW:454.561783313751
CID:634004
PubChem ID:71408472
Update Time:2025-04-19
1H-Pyrazole, 4,5-dihydro-3,5-bis[4-(methylsulfonyl)phenyl]-1-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole, 4,5-dihydro-3,5-bis[4-(methylsulfonyl)phenyl]-1-phenyl-
- 3,5-bis(4-methylsulfonylphenyl)-2-phenyl-3,4-dihydropyrazole
- DTXSID80828284
- 3,5-Bis[4-(methanesulfonyl)phenyl]-1-phenyl-4,5-dihydro-1H-pyrazole
- 88405-34-9
-
- Inchi： 1S/C23H22N2O4S2/c1-30(26,27)20-12-8-17(9-13-20)22-16-23(25(24-22)19-6-4-3-5-7-19)18-10-14-21(15-11-18)31(2,28)29/h3-15,23H,16H2,1-2H3
- InChI Key： XERCBHUEMOSQEP-UHFFFAOYSA-N
- SMILES： S(C)(C1C=CC(=CC=1)C1CC(C2C=CC(=CC=2)S(C)(=O)=O)=NN1C1C=CC=CC=1)(=O)=O
Computed Properties
- Exact Mass: 454.10209953g/mol
- Monoisotopic Mass: 454.10209953g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 31
- Rotatable Bond Count: 5
- Complexity: 850
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 101?2
1H-Pyrazole, 4,5-dihydro-3,5-bis[4-(methylsulfonyl)phenyl]-1-phenyl- Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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