Cas no 62005-04-3 (Acetic acid, [2-(phenylmethoxy)ethoxy]-, ethyl ester)
![Acetic acid, [2-(phenylmethoxy)ethoxy]-, ethyl ester structure](https://ossimg.kuujia.com/scimg/62500/62005-04-3x500.png)
62005-04-3 structure
Product Name:Acetic acid, [2-(phenylmethoxy)ethoxy]-, ethyl ester
CAS No:62005-04-3
MF:C13H18O4
MW:238.279624462128
CID:460849
PubChem ID:54389372
Update Time:2025-04-19
Acetic acid, [2-(phenylmethoxy)ethoxy]-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, [2-(phenylmethoxy)ethoxy]-, ethyl ester
- ethyl 2-(2-phenylmethoxyethoxy)acetate
- SCHEMBL21801168
- DTXSID80711026
- VFNKONPSWSBHQI-UHFFFAOYSA-N
- ethyl (2-benzyloxyethoxy)acetate
- 62005-04-3
- Ethyl [2-(benzyloxy)ethoxy]acetate
-
- Inchi： 1S/C13H18O4/c1-2-17-13(14)11-16-9-8-15-10-12-6-4-3-5-7-12/h3-7H,2,8-11H2,1H3
- InChI Key： VFNKONPSWSBHQI-UHFFFAOYSA-N
- SMILES： O(CC1C=CC=CC=1)CCOCC(=O)OCC
Computed Properties
- Exact Mass: 238.12054
- Monoisotopic Mass: 238.12050905g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 9
- Complexity: 200
- 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: 1.7
- Topological Polar Surface Area: 44.8?2
Experimental Properties
- PSA: 44.76
Acetic acid, [2-(phenylmethoxy)ethoxy]-, ethyl ester Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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