Cas no 61606-97-1 (Quinoline, 2-methyl-4-phenoxy-)
61606-97-1 structure
Product Name:Quinoline, 2-methyl-4-phenoxy-
CAS No:61606-97-1
MF:C16H13NO
MW:235.280524015427
CID:473023
PubChem ID:15560680
Update Time:2025-04-19
Quinoline, 2-methyl-4-phenoxy- Chemical and Physical Properties
Names and Identifiers
-
- Quinoline, 2-methyl-4-phenoxy-
- 2-methyl-4-phenoxyquinoline
- 61606-97-1
- DTXSID90574164
- SCHEMBL7532440
-
- Inchi： 1S/C16H13NO/c1-12-11-16(18-13-7-3-2-4-8-13)14-9-5-6-10-15(14)17-12/h2-11H,1H3
- InChI Key： NWTGGSDMRGCAQM-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1)C1C=C(C)N=C2C=CC=CC=12
Computed Properties
- Exact Mass: 235.09979
- Monoisotopic Mass: 235.099714038g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 262
- 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: 4.4
- Topological Polar Surface Area: 22.1?2
Experimental Properties
- PSA: 22.12
Quinoline, 2-methyl-4-phenoxy- Related Literature
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Danlei Xiang Nanoscale, 2021,13, 5497-5506
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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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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