Cas no 61381-90-6 (Benzenamine, 4-(4-amino-3-bromophenoxy)-2,6-dibromo-)
61381-90-6 structure
Product Name:Benzenamine, 4-(4-amino-3-bromophenoxy)-2,6-dibromo-
CAS No:61381-90-6
MF:C12H9Br3N2O
MW:436.92466044426
CID:481480
PubChem ID:12287908
Update Time:2025-04-19
Benzenamine, 4-(4-amino-3-bromophenoxy)-2,6-dibromo- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine, 4-(4-amino-3-bromophenoxy)-2,6-dibromo-
- 4-(4-amino-3-bromophenoxy)-2,6-dibromoaniline
- 61381-90-6
- DTXSID60484645
-
- Inchi： 1S/C12H9Br3N2O/c13-8-3-6(1-2-11(8)16)18-7-4-9(14)12(17)10(15)5-7/h1-5H,16-17H2
- InChI Key： XUXFTNBPAITMAY-UHFFFAOYSA-N
- SMILES： BrC1C(=C(C=C(C=1)OC1C=CC(=C(C=1)Br)N)Br)N
Computed Properties
- Exact Mass: 433.82647
- Monoisotopic Mass: 433.82650g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 270
- 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: 4.2
- Topological Polar Surface Area: 61.3?2
Experimental Properties
- PSA: 61.27
Benzenamine, 4-(4-amino-3-bromophenoxy)-2,6-dibromo- Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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