Cas no 165803-86-1 (Benzoic acid, 3-bromo-5-(2-hydroxyethyl)-, ethyl ester)
165803-86-1 structure
Product Name:Benzoic acid, 3-bromo-5-(2-hydroxyethyl)-, ethyl ester
CAS No:165803-86-1
MF:C11H13BrO3
MW:273.123122930527
CID:2153997
Update Time:2023-08-05
Benzoic acid, 3-bromo-5-(2-hydroxyethyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- ethyl 3-bromo-5-(2-hydroxyethyl)benzoate
- Benzoic acid, 3-bromo-5-(2-hydroxyethyl)-, ethyl ester
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- Inchi： 1S/C11H13BrO3/c1-2-15-11(14)9-5-8(3-4-13)6-10(12)7-9/h5-7,13H,2-4H2,1H3
- InChI Key： CCAUBJMLHIYWIX-UHFFFAOYSA-N
- SMILES： BrC1C=C(C(=O)OCC)C=C(C=1)CCO
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 208
- Topological Polar Surface Area: 46.5
Benzoic acid, 3-bromo-5-(2-hydroxyethyl)-, ethyl ester Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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5. 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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