Cas no 90016-25-4 (Ethanone, 1,1'-(oxydi-4,1-phenylene)bis[2-(4-bromophenyl)-)
90016-25-4 structure
Product Name:Ethanone, 1,1'-(oxydi-4,1-phenylene)bis[2-(4-bromophenyl)-
CAS No:90016-25-4
MF:C28H20Br2O3
MW:564.26460647583
CID:796424
PubChem ID:58813192
Update Time:2025-04-19
Ethanone, 1,1'-(oxydi-4,1-phenylene)bis[2-(4-bromophenyl)- Chemical and Physical Properties
Names and Identifiers
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- 2-(4-bromophenyl)-1-[4-[4-[2-(4-bromophenyl)acetyl]phenoxy]phenyl]ethanone
- 90016-25-4
- DTXSID50730305
- SCHEMBL14586714
- 1,1'-[Oxydi(4,1-phenylene)]bis[2-(4-bromophenyl)ethan-1-one]
- Ethanone, 1,1'-(oxydi-4,1-phenylene)bis[2-(4-bromophenyl)-
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- Inchi： 1S/C28H20Br2O3/c29-23-9-1-19(2-10-23)17-27(31)21-5-13-25(14-6-21)33-26-15-7-22(8-16-26)28(32)18-20-3-11-24(30)12-4-20/h1-16H,17-18H2
- InChI Key： GDCHBPNXZZNDHO-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1)CC(C1C=CC(=CC=1)OC1C=CC(=CC=1)C(CC1C=CC(=CC=1)Br)=O)=O
Computed Properties
- Exact Mass: 563.97587g/mol
- Monoisotopic Mass: 561.97792g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 33
- Rotatable Bond Count: 8
- Complexity: 567
- 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: 7.4
- Topological Polar Surface Area: 43.4?2
Ethanone, 1,1'-(oxydi-4,1-phenylene)bis[2-(4-bromophenyl)- Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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