Cas no 89193-17-9 (1H-Pyrazole-4-carboxylic acid, 5-ethyl-1-phenyl-, ethyl ester)
89193-17-9 structure
Product Name:1H-Pyrazole-4-carboxylic acid, 5-ethyl-1-phenyl-, ethyl ester
CAS No:89193-17-9
MF:C14H16N2O2
MW:244.289043426514
CID:609284
PubChem ID:13185107
Update Time:2025-04-19
1H-Pyrazole-4-carboxylic acid, 5-ethyl-1-phenyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrazole-4-carboxylic acid, 5-ethyl-1-phenyl-, ethyl ester
- ethyl 5-ethyl-1-phenylpyrazole-4-carboxylate
- SCHEMBL13887595
- DTXSID00525703
- 89193-17-9
- Ethyl 5-ethyl-1-phenyl-1H-pyrazole-4-carboxylate
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- Inchi： 1S/C14H16N2O2/c1-3-13-12(14(17)18-4-2)10-15-16(13)11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3
- InChI Key： GMXDPARCYACWPF-UHFFFAOYSA-N
- SMILES： O(CC)C(C1C=NN(C2C=CC=CC=2)C=1CC)=O
Computed Properties
- Exact Mass: 244.121177757g/mol
- Monoisotopic Mass: 244.121177757g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 277
- 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: 2.9
- Topological Polar Surface Area: 44.1?2
1H-Pyrazole-4-carboxylic acid, 5-ethyl-1-phenyl-, ethyl ester Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
89193-17-9 (1H-Pyrazole-4-carboxylic acid, 5-ethyl-1-phenyl-, ethyl ester) Related Products
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