Cas no 181312-04-9 (Proline,1-acetyl-5-oxo-, methyl ester)
181312-04-9 structure
Product Name:Proline,1-acetyl-5-oxo-, methyl ester
CAS No:181312-04-9
MF:C8H11NO4
MW:185.177242517471
CID:113646
PubChem ID:45120208
Update Time:2025-04-18
Proline,1-acetyl-5-oxo-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Proline,1-acetyl-5-oxo-, methyl ester
- 181312-04-9
- (S)-Methyl 1-acetyl-5-oxopyrrolidine-2-carboxylate
- Proline, 1-acetyl-5-oxo-, methyl ester
-
- Inchi： 1S/C8H11NO4/c1-5(10)9-6(8(12)13-2)3-4-7(9)11/h6H,3-4H2,1-2H3/t6-/m0/s1
- InChI Key： HQGVCWDRTRFDDV-LURJTMIESA-N
- SMILES： O(C)C([C@@H]1CCC(N1C(C)=O)=O)=O
Computed Properties
- Exact Mass: 185.06880783g/mol
- Monoisotopic Mass: 185.06880783g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 261
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.5
- Topological Polar Surface Area: 63.7?2
Proline,1-acetyl-5-oxo-, methyl ester Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
181312-04-9 (Proline,1-acetyl-5-oxo-, methyl ester) Related Products
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- 27460-51-1(Ac-pro-ome)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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