Cas no 392322-92-8 (Benzamide,4-cyano-N-(2-ethylphenyl)-)
392322-92-8 structure
Product Name:Benzamide,4-cyano-N-(2-ethylphenyl)-
CAS No:392322-92-8
MF:C16H14N2O
MW:250.295163631439
CID:299314
PubChem ID:2674949
Update Time:2025-04-19
Benzamide,4-cyano-N-(2-ethylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzamide,4-cyano-N-(2-ethylphenyl)-
- Benzamide, 4-cyano-N-(2-ethylphenyl)- (9CI)
- 4-Cyano-N-(2-ethylphenyl)benzamide
- Oprea1_353803
- AKOS000177279
- 392322-92-8
- Z29649380
- DTXSID10369019
-
- Inchi： 1S/C16H14N2O/c1-2-13-5-3-4-6-15(13)18-16(19)14-9-7-12(11-17)8-10-14/h3-10H,2H2,1H3,(H,18,19)
- InChI Key： RNWQKXDGDAWIRA-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC(C#N)=CC=1)NC1C=CC=CC=1CC
Computed Properties
- Exact Mass: 250.11072
- Monoisotopic Mass: 250.110613074g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 349
- 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: 2.7
- Topological Polar Surface Area: 52.9?2
Experimental Properties
- PSA: 52.89
Benzamide,4-cyano-N-(2-ethylphenyl)- Related Literature
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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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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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
-
Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
-
Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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