Cas no 125511-34-4 (Proline, propyl ester)
Proline, propyl ester structure
Product Name:Proline, propyl ester
CAS No:125511-34-4
MF:C8H15NO2
MW:157.210202455521
CID:103542
PubChem ID:11708099
Update Time:2025-04-18
Proline, propyl ester Chemical and Physical Properties
Names and Identifiers
-
- Proline, propyl ester
- Proline, propyl ester (9CI)
- SCHEMBL8009501
- 134666-85-6
- 125511-34-4
- propyl (2S)-pyrrolidine-2-carboxylate
- (S)-Propyl pyrrolidine-2-carboxylate
-
- Inchi： 1S/C8H15NO2/c1-2-6-11-8(10)7-4-3-5-9-7/h7,9H,2-6H2,1H3/t7-/m0/s1
- InChI Key： ZEERPIASPMMKRH-ZETCQYMHSA-N
- SMILES： O(CCC)C([C@@H]1CCCN1)=O
Computed Properties
- Exact Mass: 157.11035
- Monoisotopic Mass: 157.110278721g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 136
- 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: 1
- Topological Polar Surface Area: 38.3?2
Experimental Properties
- PSA: 38.33
Proline, propyl ester Related Literature
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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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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
125511-34-4 (Proline, propyl ester) Related Products
- 15862-72-3(ethyl piperidine-2-carboxylate)
- 30727-18-5(Ethyl 1-methylpiperidine-2-carboxylate)
- 41994-45-0(methyl piperidine-2-carboxylate)
- 41994-50-7(2,5-diethyl pyrrolidine-2,5-dicarboxylate)
- 2812-46-6(tert-butyl (2S)-pyrrolidine-2-carboxylate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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