Cas no 89326-67-0 (Benzenebutanoic acid, 4-(1-oxopropyl)-, ethyl ester)
89326-67-0 structure
Product Name:Benzenebutanoic acid, 4-(1-oxopropyl)-, ethyl ester
CAS No:89326-67-0
MF:C15H20O3
MW:248.317504882813
CID:604157
PubChem ID:71323608
Update Time:2025-04-19
Benzenebutanoic acid, 4-(1-oxopropyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzenebutanoic acid, 4-(1-oxopropyl)-, ethyl ester
- ethyl 4-(4-propanoylphenyl)butanoate
- 89326-67-0
- DTXSID70753177
-
- Inchi: 1S/C15H20O3/c1-3-14(16)13-10-8-12(9-11-13)6-5-7-15(17)18-4-2/h8-11H,3-7H2,1-2H3
- InChI Key: CUFUBSJXHIDHAT-UHFFFAOYSA-N
- SMILES: O(CC)C(CCCC1C=CC(C(CC)=O)=CC=1)=O
Computed Properties
- Exact Mass: 248.14124450g/mol
- Monoisotopic Mass: 248.14124450g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 8
- 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: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 43.4?2
Benzenebutanoic acid, 4-(1-oxopropyl)-, 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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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
89326-67-0 (Benzenebutanoic acid, 4-(1-oxopropyl)-, ethyl ester) Related Products
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