Cas no 114718-40-0 (L-Proline,3-hydroxy-5-methyl-, methyl ester, (2a,3b,5b)- (9CI))
114718-40-0 structure
Product Name:L-Proline,3-hydroxy-5-methyl-, methyl ester, (2a,3b,5b)- (9CI)
CAS No:114718-40-0
MF:C7H13NO3
MW:159.183022260666
CID:130436
PubChem ID:13891968
Update Time:2025-04-19
L-Proline,3-hydroxy-5-methyl-, methyl ester, (2a,3b,5b)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- L-Proline,3-hydroxy-5-methyl-, methyl ester, (2a,3b,5b)- (9CI)
- L-Proline, 3-hydroxy-5-methyl-, methyl ester, (2alpha,3beta,5beta)- (9CI)
- (2a,3b,5b)-3-hydroxy-5-Methyl-L-Proline Methyl ester
- (2S,3S,5R)-Methyl 3-hydroxy-5-methylpyrrolidine-2-carboxylate
- METHYL (2S,3S,5R)-3-HYDROXY-5-METHYLPYRROLIDINE-2-CARBOXYLATE
- 114718-40-0
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- Inchi： 1S/C7H13NO3/c1-4-3-5(9)6(8-4)7(10)11-2/h4-6,8-9H,3H2,1-2H3/t4-,5+,6+/m1/s1
- InChI Key： NDYLGOSCKAEYLM-SRQIZXRXSA-N
- SMILES： O[C@@H]1[C@@H](C(=O)OC)N[C@H](C)C1
Computed Properties
- Exact Mass: 159.08959
- Monoisotopic Mass: 159.08954328g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 160
- 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: 0.2
- Topological Polar Surface Area: 58.6?2
Experimental Properties
- PSA: 58.56
L-Proline,3-hydroxy-5-methyl-, methyl ester, (2a,3b,5b)- (9CI) Related Literature
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
114718-40-0 (L-Proline,3-hydroxy-5-methyl-, methyl ester, (2a,3b,5b)- (9CI)) Related Products
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- 114676-47-0((2R,4R)-Methyl 4-hydroxypyrrolidine-2-carboxylate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
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