Cas no 68548-48-1 (3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide)
68548-48-1 structure
Product Name:3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide
CAS No:68548-48-1
MF:C7H12N2O3
MW:172.181781768799
CID:1729233
PubChem ID:3052160
Update Time:2025-04-21
3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide Chemical and Physical Properties
Names and Identifiers
-
- 3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide
- 3-(4-Hydroxy-2-oxopyrrolidin-1-yl)propanimidic acid
- (+-)-4-Hydroxy-2-oxo-1-pyrrolidinepropanamide
- 1-Pyrrolidinepropanamide, 4-hydroxy-2-oxo-, (+-)-
- AKOS013476008
- DTXSID50988223
- SCHEMBL11521794
- 68548-48-1
- BRN 1528950
-
- Inchi： 1S/C7H12N2O3/c8-6(11)1-2-9-4-5(10)3-7(9)12/h5,10H,1-4H2,(H2,8,11)
- InChI Key： URSOMCJSYBJWSF-UHFFFAOYSA-N
- SMILES： OC1CC(N(CCC(N)=O)C1)=O
Computed Properties
- Exact Mass: 172.08486
- Monoisotopic Mass: 172.084792
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 205
- 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: 83.6
- XLogP3: -2.3
Experimental Properties
- Density: 1.343
- Boiling Point: 504.9°C at 760 mmHg
- Flash Point: 259.1°C
- Refractive Index: 1.557
- PSA: 83.63
3-(4-hydroxy-2-oxopyrrolidin-1-yl)propanamide Related Literature
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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