Cas no 573716-61-7 (5-chloro-2-(1-methylethyl)-1H-Indole)
573716-61-7 structure
Product Name:5-chloro-2-(1-methylethyl)-1H-Indole
CAS No:573716-61-7
MF:C11H12ClN
MW:193.672681808472
CID:1114254
PubChem ID:22573997
Update Time:2025-04-20
5-chloro-2-(1-methylethyl)-1H-Indole Chemical and Physical Properties
Names and Identifiers
-
- 5-chloro-2-(1-methylethyl)-1H-Indole
- 5-chloro-2-propan-2-yl-1H-indole
- 573716-61-7
- DTXSID70626630
- 5-chloro-2-isopropyl-1h-indole
- SCHEMBL5731862
- 5-Chloro-2-(propan-2-yl)-1H-indole
- 1H-Indole, 5-chloro-2-(1-methylethyl)-
- 5-chloro-2-isopropylindole
- YYRJXVNEZQLQKS-UHFFFAOYSA-N
-
- Inchi： 1S/C11H12ClN/c1-7(2)11-6-8-5-9(12)3-4-10(8)13-11/h3-7,13H,1-2H3
- InChI Key： YYRJXVNEZQLQKS-UHFFFAOYSA-N
- SMILES： ClC1C=CC2=C(C=1)C=C(C(C)C)N2
Computed Properties
- Exact Mass: 193.0658271g/mol
- Monoisotopic Mass: 193.0658271g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 181
- 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: 15.8?2
5-chloro-2-(1-methylethyl)-1H-Indole Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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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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3. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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