Cas no 197961-37-8 ([1,1'-Biphenyl]-2-amine, 4,4'-dibromo-)
197961-37-8 structure
Product Name:[1,1'-Biphenyl]-2-amine, 4,4'-dibromo-
CAS No:197961-37-8
MF:C12H9Br2N
MW:327.014561414719
CID:1388965
PubChem ID:4559420
Update Time:2025-04-20
[1,1'-Biphenyl]-2-amine, 4,4'-dibromo- Chemical and Physical Properties
Names and Identifiers
-
- [1,1'-Biphenyl]-2-amine, 4,4'-dibromo-
- [1,1’-Biphenyl]-2-amine, 4,4’-dibromo-
- HLTBLXGLNPWUII-UHFFFAOYSA-N
- 5-bromo-2-(4-bromophenyl)aniline
- 4,4'-Dibromo-[1,1'-biphenyl]-2-amine
- 4,4'-dibromo[1,1'-biphenyl]-2-ylamine
- AKOS024339095
- 197961-37-8
- SCHEMBL5899210
- 4,4'-Dibromo-2-amino-1,1'-biphenyl
-
- Inchi: 1S/C12H9Br2N/c13-9-3-1-8(2-4-9)11-6-5-10(14)7-12(11)15/h1-7H,15H2
- InChI Key: HLTBLXGLNPWUII-UHFFFAOYSA-N
- SMILES: BrC1C=CC(=C(C=1)N)C1C=CC(=CC=1)Br
Computed Properties
- Exact Mass: 324.91017
- Monoisotopic Mass: 324.91
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 202
- 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
- Topological Polar Surface Area: 26A^2
- XLogP3: 4.2
Experimental Properties
- PSA: 26.02
[1,1'-Biphenyl]-2-amine, 4,4'-dibromo- Related Literature
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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