Cas no 75702-88-4 (1H-Pyrazole, 4-methoxy-1-(1-methylethyl)-)
75702-88-4 structure
Product Name:1H-Pyrazole, 4-methoxy-1-(1-methylethyl)-
CAS No:75702-88-4
MF:C7H12N2O
MW:140.182981491089
CID:539111
PubChem ID:13018404
Update Time:2025-04-19
1H-Pyrazole, 4-methoxy-1-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrazole, 4-methoxy-1-(1-methylethyl)-
- 4-methoxy-1-propan-2-ylpyrazole
- DTXSID10515312
- 75702-88-4
- SCHEMBL10972730
- 1-isopropyl-4-methoxy-1H-pyrazole
- 4-Methoxy-1-(propan-2-yl)-1H-pyrazole
-
- Inchi： 1S/C7H12N2O/c1-6(2)9-5-7(10-3)4-8-9/h4-6H,1-3H3
- InChI Key： WIRJVOVMDKBPCP-UHFFFAOYSA-N
- SMILES： O(C)C1C=NN(C=1)C(C)C
Computed Properties
- Exact Mass: 140.094963011g/mol
- Monoisotopic Mass: 140.094963011g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 106
- 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: 0.9
- Topological Polar Surface Area: 27?2
1H-Pyrazole, 4-methoxy-1-(1-methylethyl)- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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