Cas no 6161-47-3 (1,1'-Biphenyl, 4,4'-dibromo-3,3'-dimethoxy-)
6161-47-3 structure
Product Name:1,1'-Biphenyl, 4,4'-dibromo-3,3'-dimethoxy-
CAS No:6161-47-3
MF:C14H12Br2O2
MW:372.051882743835
CID:472772
PubChem ID:11682231
Update Time:2025-04-19
1,1'-Biphenyl, 4,4'-dibromo-3,3'-dimethoxy- Chemical and Physical Properties
Names and Identifiers
-
- 1,1'-Biphenyl, 4,4'-dibromo-3,3'-dimethoxy-
- 1-bromo-4-(4-bromo-3-methoxyphenyl)-2-methoxybenzene
- DTXSID80470565
- 6161-47-3
- SCHEMBL4312617
-
- Inchi： 1S/C14H12Br2O2/c1-17-13-7-9(3-5-11(13)15)10-4-6-12(16)14(8-10)18-2/h3-8H,1-2H3
- InChI Key： KFKPPWZNEKLQLF-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1OC)C1C=CC(=C(C=1)OC)Br
Computed Properties
- Exact Mass: 369.92036
- Monoisotopic Mass: 369.92040g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 236
- 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: 4.9
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- PSA: 18.46
1,1'-Biphenyl, 4,4'-dibromo-3,3'-dimethoxy- Related Literature
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
-
Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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