Cas no 110193-56-1 (Methyl 2-(diethylamino)-2-oxoacetate)
110193-56-1 structure
Product Name:Methyl 2-(diethylamino)-2-oxoacetate
CAS No:110193-56-1
MF:C7H13NO3
MW:159.183022260666
CID:1196475
PubChem ID:13905249
Update Time:2025-04-20
Methyl 2-(diethylamino)-2-oxoacetate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 2-(diethylamino)-2-oxoacetate
- Methyl (diethylamino)(oxo)acetate
- 110193-56-1
- DTXSID00552236
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- Inchi： 1S/C7H13NO3/c1-4-8(5-2)6(9)7(10)11-3/h4-5H2,1-3H3
- InChI Key： LLETVLBQWAVWAY-UHFFFAOYSA-N
- SMILES： O=C(C(=O)OC)N(CC)CC
Computed Properties
- Exact Mass: 159.08954328g/mol
- Monoisotopic Mass: 159.08954328g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 152
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.7
- Topological Polar Surface Area: 46.6?2
Methyl 2-(diethylamino)-2-oxoacetate Related Literature
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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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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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