Cas no 863753-06-4 (1-(2-hydroxyethyl)-5-methyl-1H-Pyrazole-3-carboxamide)
863753-06-4 structure
Product Name:1-(2-hydroxyethyl)-5-methyl-1H-Pyrazole-3-carboxamide
CAS No:863753-06-4
MF:C7H11N3O2
MW:169.181141138077
CID:1119520
PubChem ID:66959052
Update Time:2025-04-20
1-(2-hydroxyethyl)-5-methyl-1H-Pyrazole-3-carboxamide Chemical and Physical Properties
Names and Identifiers
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- 1-(2-hydroxyethyl)-5-methyl-1H-Pyrazole-3-carboxamide
- SCHEMBL1234399
- RDAFXQQUXCQHIZ-UHFFFAOYSA-N
- DTXSID501215582
- Z1255448517
- 863753-06-4
- DB-179892
-
- Inchi： 1S/C7H11N3O2/c1-5-4-6(7(8)12)9-10(5)2-3-11/h4,11H,2-3H2,1H3,(H2,8,12)
- InChI Key： RDAFXQQUXCQHIZ-UHFFFAOYSA-N
- SMILES： OCCN1C(C)=CC(C(N)=O)=N1
Computed Properties
- Exact Mass: 169.085126602g/mol
- Monoisotopic Mass: 169.085126602g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 174
- 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: 81.1?2
1-(2-hydroxyethyl)-5-methyl-1H-Pyrazole-3-carboxamide Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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