Cas no 62613-78-9 (Propanoic acid, 3-[bis(2-ethoxy-2-oxoethyl)amino]-3-oxo-, ethyl ester)
![Propanoic acid, 3-[bis(2-ethoxy-2-oxoethyl)amino]-3-oxo-, ethyl ester structure](https://ossimg.kuujia.com/scimg/63000/62613-78-9x500.png)
62613-78-9 structure
Product Name:Propanoic acid, 3-[bis(2-ethoxy-2-oxoethyl)amino]-3-oxo-, ethyl ester
CAS No:62613-78-9
MF:C13H21NO7
MW:303.308344602585
CID:438214
PubChem ID:12365602
Update Time:2025-04-19
Propanoic acid, 3-[bis(2-ethoxy-2-oxoethyl)amino]-3-oxo-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 3-[bis(2-ethoxy-2-oxoethyl)amino]-3-oxo-, ethyl ester
- ethyl 3-[bis(2-ethoxy-2-oxoethyl)amino]-3-oxopropanoate
- DTXSID50494435
- 62613-78-9
-
- Inchi： 1S/C13H21NO7/c1-4-19-11(16)7-10(15)14(8-12(17)20-5-2)9-13(18)21-6-3/h4-9H2,1-3H3
- InChI Key： WHXAVFNIOQBCDU-UHFFFAOYSA-N
- SMILES： O(CC)C(CN(C(CC(=O)OCC)=O)CC(=O)OCC)=O
Computed Properties
- Exact Mass: 303.13183
- Monoisotopic Mass: 303.13180201g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 21
- Rotatable Bond Count: 12
- Complexity: 361
- 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: 99.2?2
Experimental Properties
- PSA: 99.21
Propanoic acid, 3-[bis(2-ethoxy-2-oxoethyl)amino]-3-oxo-, ethyl ester Related Literature
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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4. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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