Cas no 120791-59-5 (1,3,3-Trimethyl-6-nitroindolin-2-one)
120791-59-5 structure
Product Name:1,3,3-Trimethyl-6-nitroindolin-2-one
CAS No:120791-59-5
MF:C11H12N2O3
MW:220.224582672119
CID:2890074
PubChem ID:67293316
Update Time:2025-04-21
1,3,3-Trimethyl-6-nitroindolin-2-one Chemical and Physical Properties
Names and Identifiers
-
- 120791-59-5
- SCHEMBL2144620
- 1,3,3-Trimethyl-6-nitroindolin-2-one
- RJTJYHOLNLWWCY-UHFFFAOYSA-N
-
- Inchi： 1S/C11H12N2O3/c1-11(2)8-5-4-7(13(15)16)6-9(8)12(3)10(11)14/h4-6H,1-3H3
- InChI Key： RJTJYHOLNLWWCY-UHFFFAOYSA-N
- SMILES： O=C1C(C)(C)C2C=CC(=CC=2N1C)[N+](=O)[O-]
Computed Properties
- Exact Mass: 220.08479225Da
- Monoisotopic Mass: 220.08479225Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 335
- 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: 1.7
- Topological Polar Surface Area: 66.1?2
1,3,3-Trimethyl-6-nitroindolin-2-one Related Literature
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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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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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
120791-59-5 (1,3,3-Trimethyl-6-nitroindolin-2-one) Related Products
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