Cas no 54629-96-8 (Pyridine,4-methyl-3-phenoxy-)
Pyridine,4-methyl-3-phenoxy- structure
Product Name:Pyridine,4-methyl-3-phenoxy-
CAS No:54629-96-8
MF:C12H11NO
MW:185.221843004227
CID:385921
PubChem ID:3016902
Update Time:2025-04-19
Pyridine,4-methyl-3-phenoxy- Chemical and Physical Properties
Names and Identifiers
-
- Pyridine,4-methyl-3-phenoxy-
- 4-Methyl-3-phenoxypyridine
- SCHEMBL9339338
- 3-phenoxy-4-methylpyridine
- FERWLTQKKCMCTA-UHFFFAOYSA-N
- EINECS 259-262-1
- CHEMBL118246
- DTXSID10203060
- NS00033150
- 54629-96-8
-
- Inchi： 1S/C12H11NO/c1-10-7-8-13-9-12(10)14-11-5-3-2-4-6-11/h2-9H,1H3
- InChI Key： FERWLTQKKCMCTA-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1)C1C=NC=CC=1C
Computed Properties
- Exact Mass: 185.08413
- Monoisotopic Mass: 185.084
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 166
- 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: 22.1?2
Experimental Properties
- Density: 1.092
- Boiling Point: 288.4°C at 760 mmHg
- Flash Point: 105.8°C
- Refractive Index: 1.569
- PSA: 22.12
Pyridine,4-methyl-3-phenoxy- Related Literature
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
54629-96-8 (Pyridine,4-methyl-3-phenoxy-) Related Products
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- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
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