Cas no 114523-78-3 (1-Piperidinecarboxylicacid, 2-ethyl-, methyl ester)
114523-78-3 structure
Product Name:1-Piperidinecarboxylicacid, 2-ethyl-, methyl ester
CAS No:114523-78-3
MF:C9H17NO2
MW:171.23678278923
CID:132429
PubChem ID:260250
Update Time:2025-04-19
1-Piperidinecarboxylicacid, 2-ethyl-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1-Piperidinecarboxylicacid, 2-ethyl-, methyl ester
- 1-Piperidinecarboxylic acid, 2-ethyl-, methyl ester
- NSC-91333
- 114523-78-3
- NCIOpen2_001572
- NSC91333
- methyl 2-ethylpiperidine-1-carboxylate
- SCHEMBL13198897
- AKOS003856121
-
- Inchi： 1S/C9H17NO2/c1-3-8-6-4-5-7-10(8)9(11)12-2/h8H,3-7H2,1-2H3
- InChI Key： ZBTFSRFAJHEWDP-UHFFFAOYSA-N
- SMILES： O(C)C(N1CCCCC1CC)=O
Computed Properties
- Exact Mass: 171.12601
- Monoisotopic Mass: 171.126
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 159
- 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
1-Piperidinecarboxylicacid, 2-ethyl-, methyl ester Related Literature
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
114523-78-3 (1-Piperidinecarboxylicacid, 2-ethyl-, methyl ester) Related Products
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