Cas no 871707-37-8 (1,1'-Biphenyl, 2,2',6-tribromo-6'-methoxy-)
871707-37-8 structure
Product Name:1,1'-Biphenyl, 2,2',6-tribromo-6'-methoxy-
CAS No:871707-37-8
MF:C13H9Br3O
MW:420.921961545944
CID:1865216
PubChem ID:11546279
Update Time:2025-04-21
1,1'-Biphenyl, 2,2',6-tribromo-6'-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- 1,1'-Biphenyl, 2,2',6-tribromo-6'-methoxy-
- 1,3-dibromo-2-(2-bromo-6-methoxyphenyl)benzene
- SCHEMBL5568763
- 871707-37-8
- DTXCID00419178
- DTXSID10468359
-
- Inchi： 1S/C13H9Br3O/c1-17-11-7-3-6-10(16)13(11)12-8(14)4-2-5-9(12)15/h2-7H,1H3
- InChI Key： UUOHXTFEPOCURL-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(=C1C1C(=CC=CC=1Br)Br)OC
Computed Properties
- Exact Mass: 419.81830Da
- Monoisotopic Mass: 417.82035Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 239
- 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: 9.2?2
1,1'-Biphenyl, 2,2',6-tribromo-6'-methoxy- Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
-
Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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