Cas no 7746-31-8 (1H-INDAZOLE, 5,6-DIMETHOXY-3-METHYL-)
7746-31-8 structure
Product Name:1H-INDAZOLE, 5,6-DIMETHOXY-3-METHYL-
CAS No:7746-31-8
MF:C10H12N2O2
MW:192.214482307434
CID:3221839
PubChem ID:11389911
Update Time:2025-04-21
1H-INDAZOLE, 5,6-DIMETHOXY-3-METHYL- Chemical and Physical Properties
Names and Identifiers
-
- 1H-INDAZOLE, 5,6-DIMETHOXY-3-METHYL-
- SCHEMBL17683153
- DB-139357
- 7746-31-8
- 5,6-dimethoxy-3-methyl-1H-indazole
- DTXSID901296247
-
- Inchi： 1S/C10H12N2O2/c1-6-7-4-9(13-2)10(14-3)5-8(7)12-11-6/h4-5H,1-3H3,(H,11,12)
- InChI Key： ZOQBOJGXVDTPEJ-UHFFFAOYSA-N
- SMILES： O(C)C1C(=CC2C(C=1)=C(C)NN=2)OC
Computed Properties
- Exact Mass: 192.089877630Da
- Monoisotopic Mass: 192.089877630Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 201
- 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: 1.9
- Topological Polar Surface Area: 47.1?2
1H-INDAZOLE, 5,6-DIMETHOXY-3-METHYL- Related Literature
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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3. 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
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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