Cas no 117821-12-2 (2-Piperidinecarboxylicacid, 3,4-dihydroxy-, [2S-(2a,3b,4a)]- (9CI))
![2-Piperidinecarboxylicacid, 3,4-dihydroxy-, [2S-(2a,3b,4a)]- (9CI) structure](https://ossimg.kuujia.com/scimg/118000/117821-12-2x500.png)
117821-12-2 structure
Product Name:2-Piperidinecarboxylicacid, 3,4-dihydroxy-, [2S-(2a,3b,4a)]- (9CI)
CAS No:117821-12-2
MF:C6H11NO4
MW:161.155842065811
CID:142429
PubChem ID:452016
Update Time:2025-04-19
2-Piperidinecarboxylicacid, 3,4-dihydroxy-, [2S-(2a,3b,4a)]- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2-Piperidinecarboxylicacid, 3,4-dihydroxy-, [2S-(2a,3b,4a)]- (9CI)
- 2S,3R,4R-3,4-Dihydroxypipecolic acid
- (2S,3R,4R)-3,4-dihydroxypiperidine-2-carboxylic acid
- DTXSID60151921
- 117821-12-2
- SCHEMBL9724466
- 2-Piperidinecarboxylic acid, 3,4-dihydroxy-, [2S-(2a,3b,4a)
- (2s,3r,4r)-3,4-dihydroxypipecolic acid
- 2-Piperidinecarboxylic acid, 3,4-dihydroxy-, (2S-(2alpha,3beta,4alpha)
-
- Inchi： 1S/C6H11NO4/c8-3-1-2-7-4(5(3)9)6(10)11/h3-5,7-9H,1-2H2,(H,10,11)/t3-,4+,5+/m1/s1
- InChI Key： SUCGXPHEYBRFIL-WISUUJSJSA-N
- SMILES： O[C@@H]1[C@@H](C(=O)O)NCC[C@H]1O
Computed Properties
- Exact Mass: 161.06883
- Monoisotopic Mass: 161.069
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 161
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: _3.8
- Topological Polar Surface Area: 89.8?2
Experimental Properties
- Density: 1.482
- Boiling Point: 394.2°C at 760 mmHg
- Flash Point: 192.2°C
- Refractive Index: 1.57
- PSA: 89.79
2-Piperidinecarboxylicacid, 3,4-dihydroxy-, [2S-(2a,3b,4a)]- (9CI) Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
117821-12-2 (2-Piperidinecarboxylicacid, 3,4-dihydroxy-, [2S-(2a,3b,4a)]- (9CI)) Related Products
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