Cas no 105393-26-8 (2-Propenoic acid, 3-[4-(1,1-dimethylethyl)phenyl]-, ethyl ester)
![2-Propenoic acid, 3-[4-(1,1-dimethylethyl)phenyl]-, ethyl ester structure](https://ossimg.kuujia.com/scimg/105500/105393-26-8x500.png)
105393-26-8 structure
Product Name:2-Propenoic acid, 3-[4-(1,1-dimethylethyl)phenyl]-, ethyl ester
CAS No:105393-26-8
MF:C15H20O2
MW:232.318104743958
CID:1152803
PubChem ID:53424249
Update Time:2025-04-20
2-Propenoic acid, 3-[4-(1,1-dimethylethyl)phenyl]-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 3-[4-(1,1-dimethylethyl)phenyl]-, ethyl ester
- ethyl 3-(4-tert-butylphenyl)prop-2-enoate
- 105393-26-8
- 4-t-butylcinnamic acid ethyl ester
- DTXSID90698450
- (E)-ethyl 3-(4-(tert-butyl)phenyl)acrylate
- PQOOCBARRHHHBD-UHFFFAOYSA-N
-
- Inchi： 1S/C15H20O2/c1-5-17-14(16)11-8-12-6-9-13(10-7-12)15(2,3)4/h6-11H,5H2,1-4H3
- InChI Key： PQOOCBARRHHHBD-UHFFFAOYSA-N
- SMILES： O(CC)C(C=CC1C=CC(=CC=1)C(C)(C)C)=O
Computed Properties
- Exact Mass: 232.1464
- Monoisotopic Mass: 232.146329876g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 265
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 4.7
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2-Propenoic acid, 3-[4-(1,1-dimethylethyl)phenyl]-, ethyl ester Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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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
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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