Cas no 73119-63-8 (2H-Pyrrol-2-one,1,5-dihydro-5,5-dimethyl-3-(1-methylethyl)-)
73119-63-8 structure
Product Name:2H-Pyrrol-2-one,1,5-dihydro-5,5-dimethyl-3-(1-methylethyl)-
CAS No:73119-63-8
MF:C9H15NO
MW:153.221502542496
CID:551747
PubChem ID:12570222
Update Time:2025-04-19
2H-Pyrrol-2-one,1,5-dihydro-5,5-dimethyl-3-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2H-Pyrrol-2-one,1,5-dihydro-5,5-dimethyl-3-(1-methylethyl)-
- 2H-Pyrrol-2-one,1,5-dihydro-5,5-dimethyl-3-(1-methylethyl)-(9CI)
- 3-Isopropyl-5,5-dimethyl-1H-pyrrol-2(5H)-one
- 73119-63-8
-
- Inchi： 1S/C9H15NO/c1-6(2)7-5-9(3,4)10-8(7)11/h5-6H,1-4H3,(H,10,11)
- InChI Key： KGNVHNRJFRQKKZ-UHFFFAOYSA-N
- SMILES： O=C1C(C(C)C)=CC(C)(C)N1
Computed Properties
- Exact Mass: 153.11545
- Monoisotopic Mass: 153.115364102g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 214
- 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: 1.4
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- PSA: 29.1
2H-Pyrrol-2-one,1,5-dihydro-5,5-dimethyl-3-(1-methylethyl)- Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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