Cas no 120807-02-5 (L-Proline,1-benzoyl-4-[(methylsulfonyl)oxy]-, cis- (9CI))
![L-Proline,1-benzoyl-4-[(methylsulfonyl)oxy]-, cis- (9CI) structure](https://ossimg.kuujia.com/scimg/121000/120807-02-5x500.png)
120807-02-5 structure
Product Name:L-Proline,1-benzoyl-4-[(methylsulfonyl)oxy]-, cis- (9CI)
CAS No:120807-02-5
MF:C13H15NO6S
MW:313.3263027668
CID:104885
PubChem ID:11120569
Update Time:2025-04-18
L-Proline,1-benzoyl-4-[(methylsulfonyl)oxy]-, cis- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- L-Proline,1-benzoyl-4-[(methylsulfonyl)oxy]-, cis- (9CI)
- (4S)-N-BENZOYL-4-(MESYLOXY)-L-PROLINE
- 1-benzoyl-4-methylsulfonyloxypyrrolidine-2-carboxylic acid
- cis-1-benzoyl-4-[(4-methylsulfonyl)oxy]-L-proline
- (cis)-1-benzoyl-4-mesyloxy-L-proline
- EC 416-040-0
- (2S,4S)-1-benzoyl-4-methylsulfonyloxypyrrolidine-2-carboxylic acid
- DTXSID20923565
- 120807-02-5
- cis-1-Benzoyl-4-mesyloxy-L-proline
- 1-Benzoyl-4-[(methanesulfonyl)oxy]proline
- (2S,4S)-1-BENZOYL-4-(METHANESULFONYLOXY)PYRROLIDINE-2-CARBOXYLIC ACID
- ZLUIBJGFQFHEPT-QWRGUYRKSA-N
- SCHEMBL10467900
- 129155-63-1
- cis-1-benzoyl-4-((4-methylsulfonyl)oxy)-L-proline
- AKOS022180568
- (2S,4S)-1-Benzoyl-4-((methylsulfonyl)oxy)pyrrolidine-2-carboxylic acid
-
- Inchi： 1S/C13H15NO6S/c1-21(18,19)20-10-7-11(13(16)17)14(8-10)12(15)9-5-3-2-4-6-9/h2-6,10-11H,7-8H2,1H3,(H,16,17)/t10-,11-/m0/s1
- InChI Key： ZLUIBJGFQFHEPT-QWRGUYRKSA-N
- SMILES： S(C)(=O)(=O)O[C@@H]1CN(C(C2C=CC=CC=2)=O)[C@H](C(=O)O)C1
Computed Properties
- Exact Mass: 313.06205
- Monoisotopic Mass: 313.06200837g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 21
- Rotatable Bond Count: 4
- Complexity: 505
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.6
- Topological Polar Surface Area: 109?2
Experimental Properties
- PSA: 100.98
L-Proline,1-benzoyl-4-[(methylsulfonyl)oxy]-, cis- (9CI) Related Literature
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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