Cas no 153501-26-9 (1H-Indole-2-carboxylicacid, 6-chloro-3-hydroxy-, ethyl ester)
153501-26-9 structure
Product Name:1H-Indole-2-carboxylicacid, 6-chloro-3-hydroxy-, ethyl ester
CAS No:153501-26-9
MF:C11H10ClNO3
MW:239.655002117157
CID:98898
PubChem ID:54708008
Update Time:2025-04-18
1H-Indole-2-carboxylicacid, 6-chloro-3-hydroxy-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-2-carboxylicacid, 6-chloro-3-hydroxy-, ethyl ester
- 6-CHLORO-3-HYDROXY-1H-INDOLE-2-CARBOXYLIC ACID ETHYL ESTER
- ethyl 6-chloro-3-hydroxy-1H-indole-2-carboxylate
- ethyl 6-chloro-3-hydroxyindole-2-carboxylate
- ETHYL6-CHLORO-3-HYDROXY-1H-INDOLE-2-CARBOXYLATE
- AB26269
- DTXSID10716120
- 153501-26-9
- FT-0766219
-
- Inchi： 1S/C11H10ClNO3/c1-2-16-11(15)9-10(14)7-4-3-6(12)5-8(7)13-9/h3-5,13-14H,2H2,1H3
- InChI Key： FLSIBDXQAOHFCX-UHFFFAOYSA-N
- SMILES： ClC1C=CC2C(=C(C(=O)OCC)NC=2C=1)O
Computed Properties
- Exact Mass: 239.03500
- Monoisotopic Mass: 239.0349209g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 274
- 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: 3.4
- Topological Polar Surface Area: 62.3?2
Experimental Properties
- PSA: 62.32000
- LogP: 2.70360
1H-Indole-2-carboxylicacid, 6-chloro-3-hydroxy-, ethyl ester Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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