Cas no 55991-56-5 (1H-Pyrrole-2,5-dione, 3-(1,1-dimethylethyl)-)
55991-56-5 structure
Product Name:1H-Pyrrole-2,5-dione, 3-(1,1-dimethylethyl)-
CAS No:55991-56-5
MF:C8H11NO2
MW:153.178442239761
CID:350156
PubChem ID:12229417
Update Time:2025-04-19
1H-Pyrrole-2,5-dione, 3-(1,1-dimethylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrole-2,5-dione, 3-(1,1-dimethylethyl)-
- 3-tert-butylpyrrole-2,5-dione
- 3-(tert-Butyl)-1H-pyrrole-2,5-dione
- GJFDBYRHAZJJBP-UHFFFAOYSA-N
- DTXSID70481448
- SCHEMBL4356684
- 55991-56-5
- T-BUTYL MALEIMIDE
-
- Inchi： 1S/C8H11NO2/c1-8(2,3)5-4-6(10)9-7(5)11/h4H,1-3H3,(H,9,10,11)
- InChI Key： GJFDBYRHAZJJBP-UHFFFAOYSA-N
- SMILES： O=C1C(=CC(N1)=O)C(C)(C)C
Computed Properties
- Exact Mass: 153.07903
- Monoisotopic Mass: 153.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 245
- 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
- Topological Polar Surface Area: 46.2?2
Experimental Properties
- PSA: 46.17
1H-Pyrrole-2,5-dione, 3-(1,1-dimethylethyl)- Related Literature
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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