Cas no 918630-52-1 (Benzonitrile, 2-(1-fluoro-2-naphthalenyl)-)
918630-52-1 structure
Product Name:Benzonitrile, 2-(1-fluoro-2-naphthalenyl)-
CAS No:918630-52-1
MF:C17H10FN
MW:247.266407489777
CID:772722
PubChem ID:11989717
Update Time:2025-04-19
Benzonitrile, 2-(1-fluoro-2-naphthalenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile, 2-(1-fluoro-2-naphthalenyl)-
- 2-(1-fluoronaphthalen-2-yl)benzonitrile
- 918630-52-1
- DTXSID20475317
-
- Inchi： 1S/C17H10FN/c18-17-15-8-4-1-5-12(15)9-10-16(17)14-7-3-2-6-13(14)11-19/h1-10H
- InChI Key： BZDPMPWVUFVHHQ-UHFFFAOYSA-N
- SMILES： FC1C2C=CC=CC=2C=CC=1C1C=CC=CC=1C#N
Computed Properties
- Exact Mass: 247.079727485g/mol
- Monoisotopic Mass: 247.079727485g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 1
- Complexity: 358
- 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: 4.6
- Topological Polar Surface Area: 23.8?2
Benzonitrile, 2-(1-fluoro-2-naphthalenyl)- Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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