Cas no 446254-82-6 (BENZENE, 1,2,3-TRIBROMO-5-(2,3-DIBROMOPHENOXY)-)
446254-82-6 structure
Product Name:BENZENE, 1,2,3-TRIBROMO-5-(2,3-DIBROMOPHENOXY)-
CAS No:446254-82-6
MF:C12H5Br5O
MW:564.687499761581
CID:3365527
PubChem ID:86208552
Update Time:2025-04-21
BENZENE, 1,2,3-TRIBROMO-5-(2,3-DIBROMOPHENOXY)- Chemical and Physical Properties
Names and Identifiers
-
- BENZENE, 1,2,3-TRIBROMO-5-(2,3-DIBROMOPHENOXY)-
- DTXSID00879930
- UNII-41I0DF60QB
- BDE-122
- Q27258434
- PBDE 122
- 2,3,3',4',5'-pentabromodiphenyl ether
- 41I0DF60QB
- 446254-82-6
-
- Inchi： 1S/C12H5Br5O/c13-7-2-1-3-10(12(7)17)18-6-4-8(14)11(16)9(15)5-6/h1-5H
- InChI Key： CDNHGSPFIUITTN-UHFFFAOYSA-N
- SMILES： C1(Br)=CC(OC2=CC=CC(Br)=C2Br)=CC(Br)=C1Br
Computed Properties
- Exact Mass: 563.62163Da
- Monoisotopic Mass: 559.62573Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- 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: 6.9
- Topological Polar Surface Area: 9.2?2
BENZENE, 1,2,3-TRIBROMO-5-(2,3-DIBROMOPHENOXY)- Related Literature
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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3. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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4. 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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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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