Cas no 753452-46-9 (2H-Pyrrol-2-one,1-(3-cyclohexen-1-yl)-1,5-dihydro-)
753452-46-9 structure
Product Name:2H-Pyrrol-2-one,1-(3-cyclohexen-1-yl)-1,5-dihydro-
CAS No:753452-46-9
MF:C10H13NO
MW:163.216322660446
CID:561846
PubChem ID:45088760
Update Time:2025-04-19
2H-Pyrrol-2-one,1-(3-cyclohexen-1-yl)-1,5-dihydro- Chemical and Physical Properties
Names and Identifiers
-
- 2H-Pyrrol-2-one,1-(3-cyclohexen-1-yl)-1,5-dihydro-
- 2H-Pyrrol-2-one,1-(3-cyclohexen-1-yl)-1,5-dihydro-(9CI)
- 1-(Cyclohex-3-en-1-yl)-1H-pyrrol-2(5H)-one
- 753452-46-9
-
- Inchi： 1S/C10H13NO/c12-10-7-4-8-11(10)9-5-2-1-3-6-9/h1-2,4,7,9H,3,5-6,8H2
- InChI Key： SJYGUPYWWJBUIF-UHFFFAOYSA-N
- SMILES： O=C1C=CCN1C1CC=CCC1
Computed Properties
- Exact Mass: 163.09979
- Monoisotopic Mass: 163.1
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 242
- 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
- Topological Polar Surface Area: 20.3A^2
- XLogP3: 1.4
Experimental Properties
- PSA: 20.31
2H-Pyrrol-2-one,1-(3-cyclohexen-1-yl)-1,5-dihydro- 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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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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3. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
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Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
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