Cas no 187035-34-3 (S-methyl 2-((tert-butoxycarbonyl)amino)-3-((methylsulfonyl)oxy)propanoate)
187035-34-3 structure
Product Name:S-methyl 2-((tert-butoxycarbonyl)amino)-3-((methylsulfonyl)oxy)propanoate
CAS No:187035-34-3
MF:C10H19NO7S
MW:297.325362443924
CID:2189889
PubChem ID:57588578
Update Time:2025-04-21
S-methyl 2-((tert-butoxycarbonyl)amino)-3-((methylsulfonyl)oxy)propanoate Chemical and Physical Properties
Names and Identifiers
-
- S-methyl 2-((tert-butoxycarbonyl)amino)-3-((methylsulfonyl)oxy)propanoate
- L-Serine, N-[(1,1-dimethylethoxy)carbonyl]-, methyl ester, methanesulfonate (ester)
- methyl (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-methylsulfonyloxypropanoate
- SCHEMBL2870929
- (S)-2-tert-Butoxycarbonylamino-3-[(methanesulfonyl)oxy]propanoic acid methyl ester
- L-Serine, N-[(1,1-dimethylethoxy)carbonyl]-O-(methylsulfonyl)-, methyl ester
- 187035-34-3
- N-[(1,1-Dimethylethoxy)carbonyl]-O-(methylsulfonyl)-L-serine methyl ester
- 85CH997NTB
- (S)-Methyl 2-((tert-butoxycarbonyl)amino)-3-((methylsulfonyl)oxy)propanoate
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- Inchi： 1S/C10H19NO7S/c1-10(2,3)18-9(13)11-7(8(12)16-4)6-17-19(5,14)15/h7H,6H2,1-5H3,(H,11,13)/t7-/m0/s1
- InChI Key： JOMYNLPKPMNRKK-ZETCQYMHSA-N
- SMILES： S(C)(=O)(=O)OC[C@@H](C(=O)OC)NC(=O)OC(C)(C)C
Computed Properties
- Exact Mass: 297.08800
- Monoisotopic Mass: 297.08822312Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 19
- Rotatable Bond Count: 8
- Complexity: 418
- 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: 0.3
- Topological Polar Surface Area: 116?2
Experimental Properties
- PSA: 116.38000
- LogP: 1.50060
S-methyl 2-((tert-butoxycarbonyl)amino)-3-((methylsulfonyl)oxy)propanoate Related Literature
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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