Cas no 132407-76-2 (5-hydroperoxy-1-methyl-2-Pyrrolidinone)
132407-76-2 structure
Product Name:5-hydroperoxy-1-methyl-2-Pyrrolidinone
CAS No:132407-76-2
MF:C5H9NO3
MW:131.129861593246
CID:899009
PubChem ID:11083917
Update Time:2025-04-19
5-hydroperoxy-1-methyl-2-Pyrrolidinone Chemical and Physical Properties
Names and Identifiers
-
- 5-hydroperoxy-1-methyl-2-Pyrrolidinone
- 2-Pyrrolidinone,5-hydroperoxy-1-methyl-(9CI)
-
- Inchi： 1S/C5H9NO3/c1-6-4(7)2-3-5(6)9-8/h5,8H,2-3H2,1H3
- InChI Key： CHJQAEDTCYTGBP-UHFFFAOYSA-N
- SMILES： O(C1CCC(N1C)=O)O
Computed Properties
- Exact Mass: 131.05827
- Monoisotopic Mass: 131.058243149g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 125
- 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: -0.7
- Topological Polar Surface Area: 49.8?2
Experimental Properties
- PSA: 49.77
5-hydroperoxy-1-methyl-2-Pyrrolidinone Related Literature
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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