Cas no 5961-36-4 (Phenol, 2-[(ethylimino)methyl]-)
5961-36-4 structure
Product Name:Phenol, 2-[(ethylimino)methyl]-
Phenol, 2-[(ethylimino)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 2-[(ethylimino)methyl]-
- 6-(ethylaminomethylidene)cyclohexa-2,4-dien-1-one
- Salicyliden-athylamin
- 5961-36-4
- AKOS027407390
- 443991-27-3
- 2-[(E)-(Ethylimino)methyl]phenol
- SCHEMBL15786312
- SCHEMBL347779
- DTXSID301301682
- DTXSID60425538
-
- Inchi: 1S/C9H11NO/c1-2-10-7-8-5-3-4-6-9(8)11/h3-7,11H,2H2,1H3/b10-7+
- InChI Key: SUCJTGMPGPJVNY-JXMROGBWSA-N
- SMILES: OC1C=CC=CC=1/C=N/CC
Computed Properties
- Exact Mass: 149.08413
- Monoisotopic Mass: 149.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 134
- 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: 1.7
- Topological Polar Surface Area: 32.6?2
Experimental Properties
- PSA: 32.59
Phenol, 2-[(ethylimino)methyl]- Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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5. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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