Cas no 93261-71-3 (2-Furancarboxylic acid,5-bromo-, [1,1'-biphenyl]-4-yl ester)
93261-71-3 structure
Product Name:2-Furancarboxylic acid,5-bromo-, [1,1'-biphenyl]-4-yl ester
CAS No:93261-71-3
MF:C17H11BrO3
MW:343.171444177628
CID:813165
PubChem ID:262303
Update Time:2025-04-19
2-Furancarboxylic acid,5-bromo-, [1,1'-biphenyl]-4-yl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Furancarboxylic acid,5-bromo-, [1,1'-biphenyl]-4-yl ester
- (4-phenylphenyl) 5-bromofuran-2-carboxylate
- 5-Brom-furan-2-carbonsaeure-<4-phenyl-phenolester>
- 5-bromo-furan-2-carboxylic acid biphenyl-4-yl ester
- biphenyl-4-yl 5-bromo-2-furoate
- NSC95756
- AKOS002521926
- NSC-95756
- 93261-71-3
- DTXSID40294300
-
- Inchi: 1S/C17H11BrO3/c18-16-11-10-15(21-16)17(19)20-14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-11H
- InChI Key: ACLQMFOVSIADTC-UHFFFAOYSA-N
- SMILES: BrC1=CC=C(C(=O)OC2C=CC(=CC=2)C2C=CC=CC=2)O1
Computed Properties
- Exact Mass: 341.98900
- Monoisotopic Mass: 341.98916g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 21
- Rotatable Bond Count: 4
- Complexity: 346
- 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: 5.4
- Topological Polar Surface Area: 39.4?2
Experimental Properties
- PSA: 39.44000
- LogP: 4.92830
2-Furancarboxylic acid,5-bromo-, [1,1'-biphenyl]-4-yl ester Related Literature
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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