Cas no 135990-00-0 (1,1'-Biphenyl, 3,5-dibromo-4-iodo-)
135990-00-0 structure
Product Name:1,1'-Biphenyl, 3,5-dibromo-4-iodo-
CAS No:135990-00-0
MF:C12H7Br2I
MW:437.89645409584
CID:2771586
PubChem ID:4652458
Update Time:2025-04-21
1,1'-Biphenyl, 3,5-dibromo-4-iodo- Chemical and Physical Properties
Names and Identifiers
-
- 3,5-Dibromo-4-iodo-1,1'-biphenyl
- 1,1'-Biphenyl, 3,5-dibromo-4-iodo-
- DTXSID30405266
- AKOS024427573
- 135990-00-0
-
- Inchi： 1S/C12H7Br2I/c13-10-6-9(7-11(14)12(10)15)8-4-2-1-3-5-8/h1-7H
- InChI Key： KHSXOXKSILOGKN-UHFFFAOYSA-N
- SMILES： IC1=C(C=C(C=C1Br)C1C=CC=CC=1)Br
Computed Properties
- Exact Mass: 437.79387Da
- Monoisotopic Mass: 435.79592Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 192
- 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: 5.6
- Topological Polar Surface Area: 0?2
1,1'-Biphenyl, 3,5-dibromo-4-iodo- Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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