Cas no 393827-07-1 (1-Piperidinecarboxylic acid, 2-ethenyl-, 1,1-dimethylethyl ester, (2S)-)
393827-07-1 structure
Product Name:1-Piperidinecarboxylic acid, 2-ethenyl-, 1,1-dimethylethyl ester, (2S)-
CAS No:393827-07-1
MF:C12H21NO2
MW:211.30064368248
CID:1506865
PubChem ID:11229595
Update Time:2025-04-21
1-Piperidinecarboxylic acid, 2-ethenyl-, 1,1-dimethylethyl ester, (2S)- Chemical and Physical Properties
Names and Identifiers
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- 1-Piperidinecarboxylic acid, 2-ethenyl-, 1,1-dimethylethyl ester, (2S)-
- 393827-07-1
- tert-Butyl (S)-2-vinylpiperidine-1-carboxylate
-
- Inchi： 1S/C12H21NO2/c1-5-10-8-6-7-9-13(10)11(14)15-12(2,3)4/h5,10H,1,6-9H2,2-4H3/t10-/m1/s1
- InChI Key： RZTACBWUQPTZHE-SNVBAGLBSA-N
- SMILES： O(C(C)(C)C)C(N1CCCC[C@H]1C=C)=O
Computed Properties
- Exact Mass: 211.15733
- Monoisotopic Mass: 211.157228913g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 243
- 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: 2.6
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- PSA: 29.54
1-Piperidinecarboxylic acid, 2-ethenyl-, 1,1-dimethylethyl ester, (2S)- Related Literature
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
393827-07-1 (1-Piperidinecarboxylic acid, 2-ethenyl-, 1,1-dimethylethyl ester, (2S)-) Related Products
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