Cas no 288844-43-9 (Phenol,2-(5-isoxazolyl)-4,6-dimethyl-)
288844-43-9 structure
Product Name:Phenol,2-(5-isoxazolyl)-4,6-dimethyl-
CAS No:288844-43-9
MF:C11H11NO2
MW:189.210542917252
CID:248950
PubChem ID:136068749
Update Time:2025-04-19
Phenol,2-(5-isoxazolyl)-4,6-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- Phenol,2-(5-isoxazolyl)-4,6-dimethyl-
- 2,4-dimethyl-6-(2H-1,2-oxazol-5-ylidene)cyclohexa-2,4-dien-1-one
- 2-(ISOXAZOL-5-YL)-4,6-DIMETHYLPHENOL
- 5-(3,5-DIMETHYL-2-HYDROXYPHENYL)ISOXAZOLE
- AG-E-93550
- CTK4G2331
- 2,4-Dimethyl-6-(1,2-oxazol-5(2H)-ylidene)cyclohexa-2,4-dien-1-one
- 2,4-DIMETHYL-6-(1,2-OXAZOL-5-YL)PHENOL
- Phenol, 2-(5-isoxazolyl)-4,6-dimethyl-
- AKOS006280034
- 288844-43-9
- DTXSID10695481
- 2, 4-dimethyl-6-(1, 2-oxazol-5-yl)phenol
-
- Inchi： 1S/C11H11NO2/c1-7-5-8(2)11(13)9(6-7)10-3-4-12-14-10/h3-6,13H,1-2H3
- InChI Key： HXWWZKBSGIKEPY-UHFFFAOYSA-N
- SMILES： O1C(=CC=N1)C1=CC(C)=CC(C)=C1O
Computed Properties
- Exact Mass: 189.07900
- Monoisotopic Mass: 189.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 411
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- Surface Charge: 0
- Tautomer Count: 5
- XLogP3: 2
- Topological Polar Surface Area: 46.3?2
Experimental Properties
- PSA: 46.26000
- LogP: 2.66400
Phenol,2-(5-isoxazolyl)-4,6-dimethyl- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
288844-43-9 (Phenol,2-(5-isoxazolyl)-4,6-dimethyl-) Related Products
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