Cas no 114376-47-5 (D-Proline, 1-acetyl-,methyl ester)
114376-47-5 structure
Product Name:D-Proline, 1-acetyl-,methyl ester
CAS No:114376-47-5
MF:C8H13NO3
MW:171.193722486496
CID:132356
PubChem ID:7408095
Update Time:2025-04-19
D-Proline, 1-acetyl-,methyl ester Chemical and Physical Properties
Names and Identifiers
-
- D-Proline, 1-acetyl-,methyl ester
- D-Proline, 1-acetyl-, methyl ester (9CI)
- (R,S)-1-Acetyl-pyrrolidine-2-carboxylic acid methyl ester
- (S)-Methyl 1-acetylpyrrolidine-2-carboxylate
- SCHEMBL14426613
- (R)-Methyl1-acetylpyrrolidine-2-carboxylate
- methyl (2R)-1-acetylpyrrolidine-2-carboxylate
- 27460-51-1
- 114376-47-5
- (R)-Methyl 1-acetylpyrrolidine-2-carboxylate
-
- Inchi： 1S/C8H13NO3/c1-6(10)9-5-3-4-7(9)8(11)12-2/h7H,3-5H2,1-2H3/t7-/m1/s1
- InChI Key： WCIXKWOJEMZXMK-SSDOTTSWSA-N
- SMILES： O(C)C([C@H]1CCCN1C(C)=O)=O
Computed Properties
- Exact Mass: 171.08959
- Monoisotopic Mass: 171.09
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 203
- 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: _0.4
- Topological Polar Surface Area: 46.6A^2
Experimental Properties
- PSA: 46.61
D-Proline, 1-acetyl-,methyl ester Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
114376-47-5 (D-Proline, 1-acetyl-,methyl ester) Related Products
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