Cas no 110086-20-9 (1H-Pyrazol-3-amine, 5-(1,1-dimethylpropyl)-)
110086-20-9 structure
Product Name:1H-Pyrazol-3-amine, 5-(1,1-dimethylpropyl)-
CAS No:110086-20-9
MF:C8H15N3
MW:153.224801301956
CID:1190719
PubChem ID:62679167
Update Time:2025-04-20
1H-Pyrazol-3-amine, 5-(1,1-dimethylpropyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazol-3-amine, 5-(1,1-dimethylpropyl)-
- 3-(2-methylbutan-2-yl)-1H-pyrazol-5-amine
- 110086-20-9
- 5-(2-methylbutan-2-yl)-1H-pyrazol-3-amine
- AKOS011973606
- EN300-1150268
-
- Inchi： 1S/C8H15N3/c1-4-8(2,3)6-5-7(9)11-10-6/h5H,4H2,1-3H3,(H3,9,10,11)
- InChI Key： BHIYJTFTWIRWOP-UHFFFAOYSA-N
- SMILES： N1C(=CC(N)=N1)C(C)(C)CC
Computed Properties
- Exact Mass: 153.12675
- 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: 133
- 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
Experimental Properties
- PSA: 54.7
1H-Pyrazol-3-amine, 5-(1,1-dimethylpropyl)- Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
110086-20-9 (1H-Pyrazol-3-amine, 5-(1,1-dimethylpropyl)-) Related Products
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
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