Cas no 66708-00-7 (1H-Pyrazol-5-ol, 3-(ethoxymethyl)-1-methyl-)
66708-00-7 structure
Product Name:1H-Pyrazol-5-ol, 3-(ethoxymethyl)-1-methyl-
CAS No:66708-00-7
MF:C7H12N2O2
MW:156.182381629944
CID:964473
PubChem ID:45121438
Update Time:2025-04-19
1H-Pyrazol-5-ol, 3-(ethoxymethyl)-1-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazol-5-ol, 3-(ethoxymethyl)-1-methyl-
- 66708-00-7
- MFCD18809413
- SY338593
- 3-(Ethoxymethyl)-1-methyl-1H-pyrazol-5-ol
-
- Inchi： 1S/C7H12N2O2/c1-3-11-5-6-4-7(10)9(2)8-6/h4,8H,3,5H2,1-2H3
- InChI Key： CEJZSLCRCAGSLJ-UHFFFAOYSA-N
- SMILES： O(CC)CC1=CC(N(C)N1)=O
Computed Properties
- Exact Mass: 156.09
- Monoisotopic Mass: 156.09
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 189
- 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
- Topological Polar Surface Area: 41.6A^2
- XLogP3: -0.1
1H-Pyrazol-5-ol, 3-(ethoxymethyl)-1-methyl- Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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