Cas no 145508-91-4 (1,2-Benzisoxazole,7-methoxy-3-methyl-)
145508-91-4 structure
Product Name:1,2-Benzisoxazole,7-methoxy-3-methyl-
CAS No:145508-91-4
MF:C9H9NO2
MW:163.173262357712
CID:101593
PubChem ID:18377512
Update Time:2025-04-18
1,2-Benzisoxazole,7-methoxy-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Benzisoxazole,7-methoxy-3-methyl-
- 3-Methyl-7-methoxy-4'-nitroflavone
- 4H-1-Benzopyran-4-one, 7-methoxy-3-methyl-2-(4-nitrophenyl)-
- 7-methoxy-3-methyl-1,2-benzisoxazole
- 7-methoxy-3-methyl-4'-nitroflavone
- 7-Methoxy-3-methyl-benz[d]isoxazol
- 7-methoxy-3-methyl-benz[d]isoxazole
- ACMC-20mpyr
- AGN-PC-00HDVI
- CTK0F7968
- 1,2-Benzisoxazole,7-methoxy-3-methyl-(9CI)
- MFCD18804949
- 145508-91-4
- 7-Methoxy-3-methylbenzisoxazole
- SY298852
- 7-Methoxy-3-methylbenzo[d]isoxazole
- 7-METHOXY-3-METHYL-1,2-BENZOXAZOLE
- SCHEMBL6993519
- WJXLGUAJQSIWCH-UHFFFAOYSA-N
-
- Inchi： 1S/C9H9NO2/c1-6-7-4-3-5-8(11-2)9(7)12-10-6/h3-5H,1-2H3
- InChI Key： WJXLGUAJQSIWCH-UHFFFAOYSA-N
- SMILES： O1C2C(=CC=CC=2C(C)=N1)OC
Computed Properties
- Exact Mass: 163.063328530g/mol
- Monoisotopic Mass: 163.063328530g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 163
- 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: 2.1
- Topological Polar Surface Area: 35.3?2
1,2-Benzisoxazole,7-methoxy-3-methyl- Related Literature
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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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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