Cas no 1215767-91-1 (5-Bromo-3-chloro-1-methoxyisoquinoline)
1215767-91-1 structure
Product Name:5-Bromo-3-chloro-1-methoxyisoquinoline
CAS No:1215767-91-1
MF:C10H7BrClNO
MW:272.525680780411
CID:2107661
Update Time:2023-08-03
5-Bromo-3-chloro-1-methoxyisoquinoline Chemical and Physical Properties
Names and Identifiers
-
- 5-bromo-3-chloro-1-methoxyisoquinoline
- HHABSPLZXXFNDP-UHFFFAOYSA-N
- 5-Bromo-3-chloro-1-methoxyisoquinoline
-
- Inchi： 1S/C10H7BrClNO/c1-14-10-6-3-2-4-8(11)7(6)5-9(12)13-10/h2-5H,1H3
- InChI Key： HHABSPLZXXFNDP-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC2C(=NC(=CC=21)Cl)OC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 1
- Complexity: 205
- Topological Polar Surface Area: 22.1
5-Bromo-3-chloro-1-methoxyisoquinoline Related Literature
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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