Cas no 61658-89-7 (9H-Carbazole, 2,3,4-trifluoro-)
61658-89-7 structure
Product Name:9H-Carbazole, 2,3,4-trifluoro-
CAS No:61658-89-7
MF:C12H6F3N
MW:221.177953243256
CID:471041
PubChem ID:71393666
Update Time:2025-04-19
9H-Carbazole, 2,3,4-trifluoro- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Carbazole, 2,3,4-trifluoro-
- 2,3,4-trifluoro-9H-carbazole
- DTXSID90815423
- 61658-89-7
-
- Inchi: 1S/C12H6F3N/c13-7-5-9-10(12(15)11(7)14)6-3-1-2-4-8(6)16-9/h1-5,16H
- InChI Key: DIYRQGWAVQRSAV-UHFFFAOYSA-N
- SMILES: FC1=C(C(=CC2=C1C1C=CC=CC=1N2)F)F
Computed Properties
- Exact Mass: 221.04528
- Monoisotopic Mass: 221.04523368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 273
- 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: 3.7
- Topological Polar Surface Area: 15.8?2
Experimental Properties
- PSA: 15.79
9H-Carbazole, 2,3,4-trifluoro- 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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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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