Cas no 17797-87-4 (Propanoic acid,3-[(1,1-dimethylethyl)amino]-3-oxo-, ethyl ester)
![Propanoic acid,3-[(1,1-dimethylethyl)amino]-3-oxo-, ethyl ester structure](https://ossimg.kuujia.com/scimg/18000/17797-87-4x500.png)
17797-87-4 structure
Product Name:Propanoic acid,3-[(1,1-dimethylethyl)amino]-3-oxo-, ethyl ester
CAS No:17797-87-4
MF:C9H17NO3
MW:187.236182928085
CID:233984
PubChem ID:253275
Update Time:2025-04-19
Propanoic acid,3-[(1,1-dimethylethyl)amino]-3-oxo-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid,3-[(1,1-dimethylethyl)amino]-3-oxo-, ethyl ester
- ethyl 3-(tert-butylamino)-3-oxopropanoate
- AC1L5NSF
- AC1Q5L2T
- AG-K-94967
- AR-1I8677
- CTK4D6651
- ethyl 3-(tert-butylamino)3-oxopropanoate
- ethyl 3-tert-buthylamino-3-oxopropanoate
- ethyl t-butylamidoacetate
- Malonamicacid, N-tert-butyl-, ethyl ester (8CI)
- Malonsaeure-ethylester-tert.-butylamid
- NSC75982
- N-tert.-Butyl-Malonsaeuremonamid-monoethylester
- N-tert-butyl(ethoxycarbonyl)acetamide
- tBuNHCOCH2COOEt
- NSC-75982
- DTXSID60291497
- 17797-87-4
- ethyl N-t-butyl-malonamate
-
- Inchi： 1S/C9H17NO3/c1-5-13-8(12)6-7(11)10-9(2,3)4/h5-6H2,1-4H3,(H,10,11)
- InChI Key： QADAZNVHNJFDTL-UHFFFAOYSA-N
- SMILES： O=C(CC(=O)OCC)NC(C)(C)C
Computed Properties
- Exact Mass: 187.12091
- Monoisotopic Mass: 187.12084340g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 5
- Complexity: 194
- 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: 0.9
- Topological Polar Surface Area: 55.4?2
Experimental Properties
- PSA: 55.4
- LogP: 1.24520
Propanoic acid,3-[(1,1-dimethylethyl)amino]-3-oxo-, ethyl ester Related Literature
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
17797-87-4 (Propanoic acid,3-[(1,1-dimethylethyl)amino]-3-oxo-, ethyl ester) Related Products
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