Cas no 919123-97-0 (3-Butyl-5-propyl-1H-pyrazole)
3-Butyl-5-propyl-1H-pyrazole structure
Product Name:3-Butyl-5-propyl-1H-pyrazole
CAS No:919123-97-0
MF:C10H18N2
MW:166.263322353363
CID:765356
Update Time:2023-08-03
3-Butyl-5-propyl-1H-pyrazole Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole, 3-butyl-5-propyl-
- 3-butyl-5-propyl-1H-pyrazole
- 3-Butyl-5-propyl-1H-pyrazole
-
- Inchi： 1S/C10H18N2/c1-3-5-7-10-8-9(6-4-2)11-12-10/h8H,3-7H2,1-2H3,(H,11,12)
- InChI Key： CSEHKUDTQKZRSZ-UHFFFAOYSA-N
- SMILES： N1C(=CC(CCCC)=N1)CCC
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 5
- Complexity: 114
- Topological Polar Surface Area: 28.7
3-Butyl-5-propyl-1H-pyrazole Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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