Cas no 282093-35-0 (Asparagine, ethylester, dihydrochloride (9CI))
282093-35-0 structure
Product Name:Asparagine, ethylester, dihydrochloride (9CI)
CAS No:282093-35-0
MF:C6H14Cl2N2O3
MW:233.092959880829
CID:248345
PubChem ID:2826606
Update Time:2025-04-19
Asparagine, ethylester, dihydrochloride (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Asparagine, ethylester, dihydrochloride (9CI)
- ETHYL 2,4-DIAMINO-4-OXOBUTANOATE DIHYDROCHLORIDE
- 282093-35-0
- ethyl 2,4-diamino-4-oxobutanoate;dihydrochloride
- 175414-76-3
- ethyl 2, 4-diamino-4-oxobutanoate;dihydrochloride
- DTXSID30385094
- ETHYL 2-AMINO-3-CARBAMOYLPROPANOATE DIHYDROCHLORIDE
- DL-Asparagine ethyl ester dihydrochloride
-
- Inchi: 1S/C6H12N2O3.2ClH/c1-2-11-6(10)4(7)3-5(8)9;;/h4H,2-3,7H2,1H3,(H2,8,9);2*1H
- InChI Key: COUJRFGPJWMMGC-UHFFFAOYSA-N
- SMILES: Cl.Cl.O(CC)C(C(CC(N)=O)N)=O
Computed Properties
- Exact Mass: 232.038
- Monoisotopic Mass: 232.038
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 5
- Complexity: 158
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 95.4?2
Asparagine, ethylester, dihydrochloride (9CI) Related Literature
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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