Cas no 114717-05-4 (L-Proline,3-hydroxy-5-methyl-, (2a,3a,5a)- (9CI))
114717-05-4 structure
Product Name:L-Proline,3-hydroxy-5-methyl-, (2a,3a,5a)- (9CI)
CAS No:114717-05-4
MF:C6H11NO3
MW:145.156441926956
CID:130432
PubChem ID:13891970
Update Time:2025-04-19
L-Proline,3-hydroxy-5-methyl-, (2a,3a,5a)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- L-Proline,3-hydroxy-5-methyl-, (2a,3a,5a)- (9CI)
- L-Proline, 3-hydroxy-5-methyl-, (2alpha,3alpha,5alpha)- (9CI)
- AKOS006355704
- (2S,3R,5S)-3-Hydroxy-5-methylpyrrolidine-2-carboxylic acid
- 114717-05-4
- (2S,3R,5S)-3-Hydroxy-5-methylpyrrolidine-2-carboxylicacid
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- Inchi： 1S/C6H11NO3/c1-3-2-4(8)5(7-3)6(9)10/h3-5,7-8H,2H2,1H3,(H,9,10)/t3-,4+,5-/m0/s1
- InChI Key： RVIGBNHLNBRMFX-LMVFSUKVSA-N
- SMILES： O[C@H]1[C@@H](C(=O)O)N[C@@H](C)C1
Computed Properties
- Exact Mass: 145.07393
- Monoisotopic Mass: 145.074
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 148
- 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
- Topological Polar Surface Area: 69.6A^2
- XLogP3: -2.4
Experimental Properties
- PSA: 69.56
L-Proline,3-hydroxy-5-methyl-, (2a,3a,5a)- (9CI) Related Literature
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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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