Cas no 62004-91-5 (Acetic acid, [2-oxo-2-(phenylmethoxy)ethoxy]-, ethyl ester)
![Acetic acid, [2-oxo-2-(phenylmethoxy)ethoxy]-, ethyl ester structure](https://ossimg.kuujia.com/scimg/62500/62004-91-5x500.png)
62004-91-5 structure
Product Name:Acetic acid, [2-oxo-2-(phenylmethoxy)ethoxy]-, ethyl ester
CAS No:62004-91-5
MF:C13H16O5
MW:252.263144493103
CID:460862
PubChem ID:71390683
Update Time:2025-04-19
Acetic acid, [2-oxo-2-(phenylmethoxy)ethoxy]-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, [2-oxo-2-(phenylmethoxy)ethoxy]-, ethyl ester
- ethyl 2-(2-oxo-2-phenylmethoxyethoxy)acetate
- 62004-91-5
- Benzyl ethyl 2,2'-oxydiacetate
- DTXSID40812583
-
- Inchi： 1S/C13H16O5/c1-2-17-12(14)9-16-10-13(15)18-8-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3
- InChI Key： HXXQDWVDFATGLP-UHFFFAOYSA-N
- SMILES： O(C(COCC(=O)OCC)=O)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 252.09978
- Monoisotopic Mass: 252.09977361g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 9
- Complexity: 258
- 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: 1.8
- Topological Polar Surface Area: 61.8?2
Experimental Properties
- PSA: 61.83
Acetic acid, [2-oxo-2-(phenylmethoxy)ethoxy]-, ethyl ester Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
-
Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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