Cas no 947255-96-1 (2-chloro-4-fluoro-1H-Indole)
2-chloro-4-fluoro-1H-Indole structure
Product Name:2-chloro-4-fluoro-1H-Indole
CAS No:947255-96-1
MF:C8H5ClFN
MW:169.583404302597
CID:1122745
PubChem ID:90761899
Update Time:2025-04-20
2-chloro-4-fluoro-1H-Indole Chemical and Physical Properties
Names and Identifiers
-
- 2-chloro-4-fluoro-1H-Indole
- 2-chloro-4-fluoroindole
- 947255-96-1
-
- Inchi： 1S/C8H5ClFN/c9-8-4-5-6(10)2-1-3-7(5)11-8/h1-4,11H
- InChI Key： ZUEUZSPLOMHDIY-UHFFFAOYSA-N
- SMILES： ClC1=CC2C(=CC=CC=2N1)F
Computed Properties
- Exact Mass: 169.0094550g/mol
- Monoisotopic Mass: 169.0094550g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 153
- 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: 3.1
- Topological Polar Surface Area: 15.8?2
2-chloro-4-fluoro-1H-Indole Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Yuan-Jun Tong,Lu-Dan Yu,Lu-Lu Wu,Shu-Ping Cao,Ru-Ping Liang,Li Zhang,Xing-Hua Xia,Jian-Ding Qiu Chem. Commun., 2018,54, 7487-7490
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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