Cas no 100050-04-2 (3-Piperidinecarboxylic acid, 1-propyl-, ethyl ester)
100050-04-2 structure
Product Name:3-Piperidinecarboxylic acid, 1-propyl-, ethyl ester
CAS No:100050-04-2
MF:C11H21NO2
MW:199.28994345665
CID:1124617
PubChem ID:13905178
Update Time:2025-04-20
3-Piperidinecarboxylic acid, 1-propyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 3-Piperidinecarboxylic acid, 1-propyl-, ethyl ester
- ethyl 1-propylpiperidine-3-carboxylate
- Z432735084
- Ethyl N-propylnipecotate
- ethyl 1-propyl-3-piperidinecarboxylate
- AKOS009621820
- SCHEMBL4513801
- DTXSID40552230
- BNVQQLWILKDWEI-UHFFFAOYSA-N
- 100050-04-2
-
- Inchi： 1S/C11H21NO2/c1-3-7-12-8-5-6-10(9-12)11(13)14-4-2/h10H,3-9H2,1-2H3
- InChI Key： BNVQQLWILKDWEI-UHFFFAOYSA-N
- SMILES： O(CC)C(C1CCCN(CCC)C1)=O
Computed Properties
- Exact Mass: 199.15733
- Monoisotopic Mass: 199.157228913g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 182
- 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: 1.9
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- PSA: 29.54
- LogP: 1.60940
3-Piperidinecarboxylic acid, 1-propyl-, ethyl ester Related Literature
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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4. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
100050-04-2 (3-Piperidinecarboxylic acid, 1-propyl-, ethyl ester) Related Products
- 25137-01-3(ethyl (3R)-piperidine-3-carboxylate)
- 37675-18-6(Ethyl (3S)-piperidine-3-carboxylate)
- 103039-88-9(Ethyl 4-methylpiperidine-4-carboxylate)
- 19728-76-8(3-Ethoxycarbonylquinolizidine)
- 5166-67-6(Ethyl 1-Methylpiperidine-3-carboxylate)
- 24252-37-7(Ethyl 1-methylpiperidine-4-carboxylate)
- 50585-89-2(Methyl piperidine-3-carboxylate)
- 1690-72-8(Methyl 1-methylpiperidine-3-carboxylate)
- 5006-62-2(Ethyl piperidine-3-carboxylate)
- 164323-85-7(methyl (3R)-piperidine-3-carboxylate)
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