Cas no 1232100-30-9 (7-(trifluoromethyl)-9H-Pyrido[3,4-b]indole)
![7-(trifluoromethyl)-9H-Pyrido[3,4-b]indole structure](https://ossimg.kuujia.com/scimg/1232500/1232100-30-9x500.png)
1232100-30-9 structure
Product Name:7-(trifluoromethyl)-9H-Pyrido[3,4-b]indole
CAS No:1232100-30-9
MF:C12H7F3N2
MW:236.192592859268
CID:1102557
PubChem ID:22185227
Update Time:2025-04-20
7-(trifluoromethyl)-9H-Pyrido[3,4-b]indole Chemical and Physical Properties
Names and Identifiers
-
- 7-(trifluoromethyl)-9H-Pyrido[3,4-b]indole
- SCHEMBL2768715
- BDBM50347606
- DB-350677
- CHEMBL1802986
- 9H-Pyrido[3,4-b]indole, 7-(trifluoromethyl)-
- UEQGBTJIWXDXDG-UHFFFAOYSA-N
- 1232100-30-9
-
- Inchi： 1S/C12H7F3N2/c13-12(14,15)7-1-2-8-9-3-4-16-6-11(9)17-10(8)5-7/h1-6,17H
- InChI Key： UEQGBTJIWXDXDG-UHFFFAOYSA-N
- SMILES： FC(C1C=CC2C3C=CN=CC=3NC=2C=1)(F)F
Computed Properties
- Exact Mass: 236.05613272g/mol
- Monoisotopic Mass: 236.05613272g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 292
- 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: 4.1
- Topological Polar Surface Area: 28.7?2
7-(trifluoromethyl)-9H-Pyrido[3,4-b]indole Related Literature
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Xu Jie,Deng Xu,Weili Wei RSC Adv., 2019,9, 29149-29153
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
1232100-30-9 (7-(trifluoromethyl)-9H-Pyrido[3,4-b]indole) Related Products
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