Cas no 61308-29-0 (1H-Indazole-1-acetic acid, 3-phenyl-, ethyl ester)
61308-29-0 structure
Product Name:1H-Indazole-1-acetic acid, 3-phenyl-, ethyl ester
CAS No:61308-29-0
MF:C17H16N2O2
MW:280.321144104004
CID:484890
PubChem ID:13330959
Update Time:2025-04-19
1H-Indazole-1-acetic acid, 3-phenyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indazole-1-acetic acid, 3-phenyl-, ethyl ester
- ethyl 2-(3-phenylindazol-1-yl)acetate
- BRD-K17670538-001-01-5
- Ethyl (3-phenyl-1H-indazol-1-yl)acetate
- SCHEMBL15631894
- 61308-29-0
- DTXSID90537113
-
- Inchi： 1S/C17H16N2O2/c1-2-21-16(20)12-19-15-11-7-6-10-14(15)17(18-19)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3
- InChI Key： ZTJVBDZCFFHIHJ-UHFFFAOYSA-N
- SMILES： O(CC)C(CN1C2C=CC=CC=2C(C2C=CC=CC=2)=N1)=O
Computed Properties
- Exact Mass: 280.12128
- Monoisotopic Mass: 280.121177757g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 5
- Complexity: 355
- 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: 3.6
- Topological Polar Surface Area: 44.1?2
Experimental Properties
- PSA: 44.12
1H-Indazole-1-acetic acid, 3-phenyl-, ethyl ester Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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