Cas no 169205-54-3 (Quinazoline, 4-(3-bromophenoxy)-)
169205-54-3 structure
Product Name:Quinazoline, 4-(3-bromophenoxy)-
CAS No:169205-54-3
MF:C14H9BrN2O
MW:301.138062238693
CID:1350362
PubChem ID:5328018
Update Time:2025-04-20
Quinazoline, 4-(3-bromophenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Quinazoline, 4-(3-bromophenoxy)-
- 4-(3-bromophenoxy)quinazoline
- DTXSID10416138
- 169205-54-3
- BDBM3268
- CHEMBL117710
- 4-Anilino quinazoline deriv. 19
- AKOS009152791
-
- Inchi： 1S/C14H9BrN2O/c15-10-4-3-5-11(8-10)18-14-12-6-1-2-7-13(12)16-9-17-14/h1-9H
- InChI Key： GHYKYLGHIXGESB-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(=C1)OC1=C2C=CC=CC2=NC=N1
Computed Properties
- Exact Mass: 299.98987
- Monoisotopic Mass: 299.98983g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 277
- 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: 35?2
Experimental Properties
- PSA: 35.01
Quinazoline, 4-(3-bromophenoxy)- Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
-
Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
-
Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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