Cas no 74744-78-8 (Ethyl 2-(4-bromo-phenoxy)-benzoate)
74744-78-8 structure
Product Name:Ethyl 2-(4-bromo-phenoxy)-benzoate
CAS No:74744-78-8
MF:C15H13BrO3
MW:321.165923833847
CID:6627977
PubChem ID:23464800
Update Time:2024-01-05
Ethyl 2-(4-bromo-phenoxy)-benzoate Chemical and Physical Properties
Names and Identifiers
-
- SCHEMBL10953526
- ethyl 2-(4-bromo-phenoxy)-benzoate
- 2-(4-bromophenoxy)benzoic acid ethyl ester
- 74744-78-8
- DTXSID901301680
- ethyl 2-(4-bromophenoxy)benzoate
- BJQYYHPYGWSGGP-UHFFFAOYSA-N
- Ethyl 2-(4-bromo-phenoxy)-benzoate
-
- Inchi： 1S/C15H13BrO3/c1-2-18-15(17)13-5-3-4-6-14(13)19-12-9-7-11(16)8-10-12/h3-10H,2H2,1H3
- InChI Key： BJQYYHPYGWSGGP-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1)OC1C=CC=CC=1C(=O)OCC
Computed Properties
- Exact Mass: 320.00481g/mol
- Monoisotopic Mass: 320.00481g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 5
- Complexity: 287
- 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: 4.5
- Topological Polar Surface Area: 35.5?2
Ethyl 2-(4-bromo-phenoxy)-benzoate Related Literature
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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