Cas no 61110-62-1 (2H-Indol-2-one, 1,3-dihydro-3-hydroxy-1,3,6-trimethyl-)
61110-62-1 structure
Product Name:2H-Indol-2-one, 1,3-dihydro-3-hydroxy-1,3,6-trimethyl-
CAS No:61110-62-1
MF:C11H13NO2
MW:191.226423025131
CID:491629
PubChem ID:12291736
Update Time:2025-04-19
2H-Indol-2-one, 1,3-dihydro-3-hydroxy-1,3,6-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2H-Indol-2-one, 1,3-dihydro-3-hydroxy-1,3,6-trimethyl-
- 3-hydroxy-1,3,6-trimethylindol-2-one
- 61110-62-1
- DTXSID40485014
- SCHEMBL5986616
-
- Inchi： 1S/C11H13NO2/c1-7-4-5-8-9(6-7)12(3)10(13)11(8,2)14/h4-6,14H,1-3H3
- InChI Key： YCCWKHMKUXNBFI-UHFFFAOYSA-N
- SMILES： OC1(C)C(N(C)C2C=C(C)C=CC1=2)=O
Computed Properties
- Exact Mass: 191.09469
- Monoisotopic Mass: 191.094628657g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 266
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1
- Topological Polar Surface Area: 40.5?2
Experimental Properties
- PSA: 40.54
2H-Indol-2-one, 1,3-dihydro-3-hydroxy-1,3,6-trimethyl- Related Literature
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Hui Liu,Deyong Su,Guolin Cheng,Jimin Xu,Xinyan Wang,Yuefei Hu Org. Biomol. Chem., 2010,8, 1899-1904
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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