Cas no 156861-94-8 (2H-Pyrrol-2-one,1,5-dihydro-3,4-dihydroxy-1-methyl-)
156861-94-8 structure
Product Name:2H-Pyrrol-2-one,1,5-dihydro-3,4-dihydroxy-1-methyl-
CAS No:156861-94-8
MF:C5H7NO3
MW:129.113981485367
CID:107613
PubChem ID:54712605
Update Time:2025-04-18
2H-Pyrrol-2-one,1,5-dihydro-3,4-dihydroxy-1-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 2H-Pyrrol-2-one,1,5-dihydro-3,4-dihydroxy-1-methyl-
- 2H-Pyrrol-2-one,1,5-dihydro-3,4-dihydroxy-1-methyl-(9CI)
- 3,4-Dihydroxy-1-methyl-1H-pyrrol-2(5H)-one
- 156861-94-8
- SCHEMBL12305806
-
- Inchi： 1S/C5H7NO3/c1-6-2-3(7)4(8)5(6)9/h7-8H,2H2,1H3
- InChI Key： ZGWMYAGTPIXFOD-UHFFFAOYSA-N
- SMILES： OC1=C(C(N(C)C1)=O)O
Computed Properties
- Exact Mass: 129.043
- Monoisotopic Mass: 129.043
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 185
- 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
- Topological Polar Surface Area: 60.8A^2
- XLogP3: -1
2H-Pyrrol-2-one,1,5-dihydro-3,4-dihydroxy-1-methyl- Related Literature
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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