Cas no 1021233-58-8 (2-[(2-Fluorophenyl)amino]benzonitrile)
![2-[(2-Fluorophenyl)amino]benzonitrile structure](https://ossimg.kuujia.com/scimg/1021500/1021233-58-8x500.png)
1021233-58-8 structure
Product Name:2-[(2-Fluorophenyl)amino]benzonitrile
CAS No:1021233-58-8
MF:C13H9FN2
MW:212.222366094589
CID:1131842
PubChem ID:28602084
Update Time:2025-04-20
2-[(2-Fluorophenyl)amino]benzonitrile Chemical and Physical Properties
Names and Identifiers
-
- 2-[(2-Fluorophenyl)amino]benzonitrile
- 2-[(2-fluorophenyl)amino]-Benzonitrile
- SCHEMBL3286845
- 2-((2-Fluorophenyl)amino)benzonitrile
- 1021233-58-8
- NCQADVDOKWDRQR-UHFFFAOYSA-N
- AKOS000260820
- DB-121894
-
- Inchi： 1S/C13H9FN2/c14-11-6-2-4-8-13(11)16-12-7-3-1-5-10(12)9-15/h1-8,16H
- InChI Key： NCQADVDOKWDRQR-UHFFFAOYSA-N
- SMILES： FC1C=CC=CC=1NC1C=CC=CC=1C#N
Computed Properties
- Exact Mass: 212.07507
- Monoisotopic Mass: 212.07497646g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 270
- 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: 3.8
- Topological Polar Surface Area: 35.8?2
Experimental Properties
- PSA: 35.82
2-[(2-Fluorophenyl)amino]benzonitrile Related Literature
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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