Cas no 78644-75-4 ( )
structure
Product Name:
CAS No:78644-75-4
MF:C11H9BrN2
MW:249.106561422348
CID:984312
PubChem ID:319456
Update Time:2025-04-20
Chemical and Physical Properties
Names and Identifiers
-
- N-(4-bromophenyl)pyridin-2-amine
- (4-bromo-phenyl)-pyridin-2-yl-amine
- N-(4-bromophenyl)-2-aminopyridine
- N-(p-Bromphenyl)-2-pyridylamin
- NSC263751
- SureCN8162368
- DTXSID10312863
- 78644-75-4
- SCHEMBL8162368
- NSC-263751
- HS-5348
- DS-011596
-
-
- Inchi： 1S/C11H9BrN2/c12-9-4-6-10(7-5-9)14-11-3-1-2-8-13-11/h1-8H,(H,13,14)
- InChI Key： NIDLRXNAADDGDT-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=CC=1)NC1C=CC=CN=1
Computed Properties
- Exact Mass: 247.99497
- Monoisotopic Mass: 247.99491g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 167
- 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: 3.4
- Topological Polar Surface Area: 24.9?2
Experimental Properties
- PSA: 24.92
- LogP: 3.66070
Related Literature
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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