Cas no 100542-54-9 (1,1'-Biphenyl, 5,5'-dibromo-2,2'-dimethoxy-)
100542-54-9 structure
Product Name:1,1'-Biphenyl, 5,5'-dibromo-2,2'-dimethoxy-
CAS No:100542-54-9
MF:C14H12Br2O2
MW:372.051882743835
CID:1126029
PubChem ID:378886
Update Time:2025-04-20
1,1'-Biphenyl, 5,5'-dibromo-2,2'-dimethoxy- Chemical and Physical Properties
Names and Identifiers
-
- 1,1'-Biphenyl, 5,5'-dibromo-2,2'-dimethoxy-
- 4,4'-dibromo-2,2'-bianisole
- 3,3'-Dibromo-6,6'-dimethoxy-1,1'-biphenyl
- NSC-662281
- 100542-54-9
- SCHEMBL14125145
- 5,5'-Dibromo-2,2'-dimethoxy-diphenyl
- YAJRLSQAVCETBJ-UHFFFAOYSA-N
- NSC662281
- 6,6'-dimethoxy-3,3'-dibromobiphenyl
- 4-bromo-2-(5-bromo-2-methoxy-phenyl)-1-methoxy-benzene
- 5,2'-dimethoxy-1,1'-biphenyl
- AKOS024433595
- 5,5'-Dibromo-2,2'-dimethoxy-1,1'-biphenyl
-
- Inchi： 1S/C14H12Br2O2/c1-17-13-5-3-9(15)7-11(13)12-8-10(16)4-6-14(12)18-2/h3-8H,1-2H3
- InChI Key： YAJRLSQAVCETBJ-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=C(C=1)C1C=C(C=CC=1OC)Br)OC
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, 5,5'-dibromo-2,2'-dimethoxy- Related Literature
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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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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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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