Cas no 864439-18-9 (1H-Pyrazol-3-amine,4-(2,2-dimethylpropyl)-)
864439-18-9 structure
Product Name:1H-Pyrazol-3-amine,4-(2,2-dimethylpropyl)-
CAS No:864439-18-9
MF:C8H15N3
MW:153.224801301956
CID:718596
PubChem ID:23156371
Update Time:2025-04-19
1H-Pyrazol-3-amine,4-(2,2-dimethylpropyl)- Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrazol-3-amine,4-(2,2-dimethylpropyl)-
- SCHEMBL5445609
- 4-Neopentyl-1H-pyrazol-5-amine
- 864439-18-9
- HWJOUXYOHKKFMG-UHFFFAOYSA-N
- 4-(2,2-dimethylpropyl)-1H-pyrazol-5-amine
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- Inchi： 1S/C8H15N3/c1-8(2,3)4-6-5-10-11-7(6)9/h5H,4H2,1-3H3,(H3,9,10,11)
- InChI Key： HWJOUXYOHKKFMG-UHFFFAOYSA-N
- SMILES： N1C(=C(C=N1)CC(C)(C)C)N
Computed Properties
- Exact Mass: 153.126597491g/mol
- Monoisotopic Mass: 153.126597491g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 128
- 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: 1.9
- Topological Polar Surface Area: 54.7?2
1H-Pyrazol-3-amine,4-(2,2-dimethylpropyl)- Related Literature
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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