Cas no 94022-67-0 (ethyl 2-[4-(1,1-dimethylethyl)phenoxy]propionate)
![ethyl 2-[4-(1,1-dimethylethyl)phenoxy]propionate structure](https://ossimg.kuujia.com/scimg/94500/94022-67-0x500.png)
94022-67-0 structure
Product Name:ethyl 2-[4-(1,1-dimethylethyl)phenoxy]propionate
CAS No:94022-67-0
MF:C15H22O3
MW:250.333384990692
CID:1000550
PubChem ID:3023318
Update Time:2025-04-20
ethyl 2-[4-(1,1-dimethylethyl)phenoxy]propionate Chemical and Physical Properties
Names and Identifiers
-
- ethyl 2-[4-(1,1-dimethylethyl)phenoxy]propionate
- ethyl 2-(4-tert-butylphenoxy)propanoate
- Ethyl 2-(4-(1,1-dimethylethyl)phenoxy)propionate
- AKOS005946186
- 2-(4tert-Butyl-phenoxy)-propionic acid ethyl ester
- 94022-67-0
- EINECS 301-565-9
- SCHEMBL4790092
- VGBZYLBDLXGDJR-UHFFFAOYSA-N
- NS00064503
- 2-(4-tert-Butyl-phenoxy)-propionic Acid Ethyl Ester
- DTXSID60916658
-
- Inchi： 1S/C15H22O3/c1-6-17-14(16)11(2)18-13-9-7-12(8-10-13)15(3,4)5/h7-11H,6H2,1-5H3
- InChI Key： VGBZYLBDLXGDJR-UHFFFAOYSA-N
- SMILES： O(C(C(=O)OCC)C)C1C=CC(=CC=1)C(C)(C)C
Computed Properties
- Exact Mass: 250.15689456g/mol
- Monoisotopic Mass: 250.15689456g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 6
- Complexity: 259
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.3
- Topological Polar Surface Area: 35.5?2
ethyl 2-[4-(1,1-dimethylethyl)phenoxy]propionate Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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