Cas no 17629-27-5 (1H-Pyrazole, 3-(4-chlorophenyl)-5-methyl-)
17629-27-5 structure
Product Name:1H-Pyrazole, 3-(4-chlorophenyl)-5-methyl-
CAS No:17629-27-5
MF:C10H9ClN2
MW:192.644860982895
CID:1363809
PubChem ID:606094
Update Time:2025-04-20
1H-Pyrazole, 3-(4-chlorophenyl)-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole, 3-(4-chlorophenyl)-5-methyl-
- 3-(4-CHLOROPHENYL)-5-METHYL-1H-PYRAZOLE
- 3-(4-chlorophenyl)-5-methylpyrazolidine
- SALOR-INT L232963-1EA
- 17629-27-5
- 3-(4-Chloro-phenyl)-5-methyl-1H-pyrazole
- A1-13984
- Pyrazole, 3-(p-chlorophenyl)-5-methyl-
- Z3300498503
- 5-(4-Chlorophenyl)-3-methyl-1H-pyrazole
- 3-(4-Chlorophenyl)-5-methyl-1H-pyrazole #
- 5-(4-chlorophenyl)-3-methylpyrazole
- G20892
- AKOS006220678
- SCHEMBL1160360
-
- Inchi： 1S/C10H9ClN2/c1-7-6-10(13-12-7)8-2-4-9(11)5-3-8/h2-6H,1H3,(H,12,13)
- InChI Key： UEOSSIMPKPNOEJ-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1)C1C=C(C)NN=1
Computed Properties
- Exact Mass: 192.04557
- Monoisotopic Mass: 192.0454260g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 166
- 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: 2.9
- Topological Polar Surface Area: 28.7?2
Experimental Properties
- PSA: 28.68
1H-Pyrazole, 3-(4-chlorophenyl)-5-methyl- Related Literature
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
-
Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
-
5. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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