Cas no 175463-36-2 ((E)-tert-Butyl 3-(((tert-butoxycarbonyl)amino)methyl)-4-(hydroxyimino)pyrrolidine-1-carboxylate)
175463-36-2 structure
Product Name:(E)-tert-Butyl 3-(((tert-butoxycarbonyl)amino)methyl)-4-(hydroxyimino)pyrrolidine-1-carboxylate
CAS No:175463-36-2
MF:C15H27N3O5
MW:329.391984224319
CID:112068
PubChem ID:6005717
Update Time:2025-04-18
(E)-tert-Butyl 3-(((tert-butoxycarbonyl)amino)methyl)-4-(hydroxyimino)pyrrolidine-1-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- (E)-tert-Butyl 3-(((tert-butoxycarbonyl)amino)methyl)-4-(hydroxyimino)pyrrolidine-1-carboxylate
- 1-Pyrrolidinecarboxylicacid, 3-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-4-(hydroxyimino)-,1,1-dimethylethyl ester
- 1-Pyrrolidinecarboxylicacid, 3-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-4-(hydroxyimino)-...
- 2-Methyl-2-propanyl (3E)-3-(hydroxyimino)-4-[({[(2-methyl-2-propa nyl)oxy]carbonyl}amino)methyl]-1-pyrrolidinecarboxylate
- 3-(pyrazin-2-yloxy)-azetidine-1-carboxylic acid tert-butyl ester
- MB07909
- SureCN2997553
- tert-butyl 3-(pyrazin-2-yloxy)azetidine-1-carboxylate
- tert-butyl 3-(tert-butoxycarbonyl)aminomethyl-4-(hydroxyimino)pyrrolidine-1-carboxylate
- 4-N-BOC-AMINOMETHYL-1-N-BOC-PYRROLIDIN-3-ONE OXIME
- 175463-36-2
- SCHEMBL8325977
-
- Inchi： 1S/C15H27N3O5/c1-14(2,3)22-12(19)16-7-10-8-18(9-11(10)17-21)13(20)23-15(4,5)6/h10,21H,7-9H2,1-6H3,(H,16,19)/b17-11-
- InChI Key： OINDMHMXFOQNJQ-BOPFTXTBSA-N
- SMILES： O(C(C)(C)C)C(N1C/C(/C(CNC(=O)OC(C)(C)C)C1)=N/O)=O
Computed Properties
- Exact Mass: 329.19521
- Monoisotopic Mass: 329.19507097g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 23
- Rotatable Bond Count: 6
- Complexity: 477
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.7
- Topological Polar Surface Area: 101?2
Experimental Properties
- PSA: 100.46
(E)-tert-Butyl 3-(((tert-butoxycarbonyl)amino)methyl)-4-(hydroxyimino)pyrrolidine-1-carboxylate Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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