Cas no 53608-81-4 (Benzenebutanoic acid, a-phenyl-, ethyl ester)
53608-81-4 structure
Product Name:Benzenebutanoic acid, a-phenyl-, ethyl ester
CAS No:53608-81-4
MF:C18H20O2
MW:268.350205421448
CID:381716
PubChem ID:256029
Update Time:2025-04-19
Benzenebutanoic acid, a-phenyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzenebutanoic acid, a-phenyl-, ethyl ester
- ETHYL 2,4-DIPHENYLBUTANOATE
- Ethyl-2,4-diphenylbutanoate
- (+-)-2,4-Diphenyl-buttersaeure-aethylester
- 2,4-Diphenyl-buttersaeure-aethylester
- 2,4-diphenyl-butyric acid ethyl ester
- AC1L5TPU
- AC1Q63XH
- AG-J-94910
- AR-1I8181
- CTK4J8476
- NSC82226
- FT-0654930
- Benzenebutanoic acid, .alpha.-phenyl-, ethyl ester
- DTXSID20292389
- NSC-82226
- 53608-81-4
- A829680
-
- Inchi： 1S/C18H20O2/c1-2-20-18(19)17(16-11-7-4-8-12-16)14-13-15-9-5-3-6-10-15/h3-12,17H,2,13-14H2,1H3
- InChI Key： SJMGLWKVOOIJRS-UHFFFAOYSA-N
- SMILES： O(CC)C(C(C1C=CC=CC=1)CCC1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 268.1464
- Monoisotopic Mass: 268.146329876g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 7
- Complexity: 275
- 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: 4.4
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
- LogP: 3.96610
Benzenebutanoic acid, a-phenyl-, ethyl ester Related Literature
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1. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
53608-81-4 (Benzenebutanoic acid, a-phenyl-, ethyl ester) Related Products
- 119-43-7(Ethyl 2-Phenylbutyrate)
- 5413-05-8(Ethyl 2-Phenylacetoacetate)
- 24817-51-4(FEMA 3632)
- 2294-71-5(Methyl 2-phenylbutanoate)
- 956-89-8(α,α-Diphenyl-γ-butyrolactone)
- 76-67-5(Diethyl ethylphenylmalonate)
- 1519-21-7(Benzeneacetic acid, a-ethyl-, 1,1'-anhydride)
- 1131-15-3(3-phenyloxolane-2,5-dione)
- 101278-21-1(Dihydro-3,4-diphenyl-2,5-furandione)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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