Cas no 59803-60-0 (1H-Pyrazole, 5-chloro-1-methyl-3-phenyl-)
59803-60-0 structure
Product Name:1H-Pyrazole, 5-chloro-1-methyl-3-phenyl-
CAS No:59803-60-0
MF:C10H9ClN2
MW:192.644860982895
CID:337253
PubChem ID:12665792
Update Time:2025-04-19
1H-Pyrazole, 5-chloro-1-methyl-3-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole, 5-chloro-1-methyl-3-phenyl-
- 5-CHLORO-1-METHYL-3-PHENYL-1H-PYRAZOLE
- 5-chloro-1-methyl-3-phenylpyrazole
- KZXLYZPMOREIDC-UHFFFAOYSA-N
- 3-phenyl-5-chloro-1-methylpyrazole
- 59803-60-0
- 5-chloro-1-methyl-3phenylpyrazole
- 1-methyl-5-chloro-3-phenylpyrazole
- 5-chloro-1-methyl-3 -phenylpyrazole
- AKOS006243120
- SCHEMBL11626360
- DTXSID30506181
- SY338452
- 3-Chloro-2-methyl-5-phenylpyrazole
- MFCD09749481
-
- Inchi： 1S/C10H9ClN2/c1-13-10(11)7-9(12-13)8-5-3-2-4-6-8/h2-7H,1H3
- InChI Key： KZXLYZPMOREIDC-UHFFFAOYSA-N
- SMILES： ClC1=CC(C2C=CC=CC=2)=NN1C
Computed Properties
- Exact Mass: 192.04557
- Monoisotopic Mass: 192.0454260g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 168
- 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: 17.8?2
Experimental Properties
- PSA: 17.82
1H-Pyrazole, 5-chloro-1-methyl-3-phenyl- Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
-
Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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