Cas no 62637-32-5 (2(3H)-Benzoxazolone, 6-methoxy-3-methyl-)
62637-32-5 structure
Product Name:2(3H)-Benzoxazolone, 6-methoxy-3-methyl-
CAS No:62637-32-5
MF:C9H9NO3
MW:179.172662496567
CID:437018
PubChem ID:11052222
Update Time:2025-04-19
2(3H)-Benzoxazolone, 6-methoxy-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 2(3H)-Benzoxazolone, 6-methoxy-3-methyl-
- 6-methoxy-3-methyl-1,3-benzoxazol-2-one
- 62637-32-5
- SCHEMBL8296662
- DTXSID70453387
-
- Inchi： 1S/C9H9NO3/c1-10-7-4-3-6(12-2)5-8(7)13-9(10)11/h3-5H,1-2H3
- InChI Key： DYTOSGZAIXNPHH-UHFFFAOYSA-N
- SMILES： O1C(N(C)C2C=CC(=CC1=2)OC)=O
Computed Properties
- Exact Mass: 179.05827
- Monoisotopic Mass: 179.058243149g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 219
- 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: 1.3
- Topological Polar Surface Area: 38.8?2
Experimental Properties
- PSA: 38.77
2(3H)-Benzoxazolone, 6-methoxy-3-methyl- Related Literature
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
-
4. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
62637-32-5 (2(3H)-Benzoxazolone, 6-methoxy-3-methyl-) Related Products
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