Cas no 918662-50-7 (Isoquinoline, 1-chloro-6-ethoxy-)
918662-50-7 structure
Product Name:Isoquinoline, 1-chloro-6-ethoxy-
CAS No:918662-50-7
MF:C11H10ClNO
MW:207.656201839447
CID:771769
PubChem ID:57893110
Update Time:2025-04-19
Isoquinoline, 1-chloro-6-ethoxy- Chemical and Physical Properties
Names and Identifiers
-
- Isoquinoline, 1-chloro-6-ethoxy-
- 1-chloro-6-ethoxyisoquinoline
- 918662-50-7
- RIVXRCRIFGIVBK-UHFFFAOYSA-N
- SCHEMBL744595
- DTXSID10728228
- 1-chloro-6-ethoxy-isoquinoline
-
- Inchi： 1S/C11H10ClNO/c1-2-14-9-3-4-10-8(7-9)5-6-13-11(10)12/h3-7H,2H2,1H3
- InChI Key： RIVXRCRIFGIVBK-UHFFFAOYSA-N
- SMILES： ClC1C2C=CC(=CC=2C=CN=1)OCC
Computed Properties
- Exact Mass: 207.0450916g/mol
- Monoisotopic Mass: 207.0450916g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 188
- 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: 22.1?2
Isoquinoline, 1-chloro-6-ethoxy- Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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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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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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