Cas no 1309379-23-4 (5-Fluorocinnoline)
5-Fluorocinnoline structure
Product Name:5-Fluorocinnoline
CAS No:1309379-23-4
MF:C8H5FN2
MW:148.13710474968
CID:5711446
PubChem ID:21467000
Update Time:2024-03-01
5-Fluorocinnoline Chemical and Physical Properties
Names and Identifiers
-
- 5-fluorocinnoline
- 1309379-23-4
- SCHEMBL8830081
- Cinnoline, 5-fluoro-
- 5-Fluorocinnoline
-
- Inchi： 1S/C8H5FN2/c9-7-2-1-3-8-6(7)4-5-10-11-8/h1-5H
- InChI Key： GQPKXWSWQHJORA-UHFFFAOYSA-N
- SMILES： FC1=CC=CC2=C1C=CN=N2
Computed Properties
- Exact Mass: 148.04367633g/mol
- Monoisotopic Mass: 148.04367633g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 140
- 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: 1.3
- Topological Polar Surface Area: 25.8?2
Experimental Properties
- Density: 1.297±0.06 g/cm3(Predicted)
- Boiling Point: 267.5±32.0 °C(Predicted)
- pka: 1.79±0.10(Predicted)
5-Fluorocinnoline Related Literature
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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