Cas no 125443-61-0 (8-bromo-4-chloro-2-phenylquinoline)
125443-61-0 structure
Product Name:8-bromo-4-chloro-2-phenylquinoline
CAS No:125443-61-0
MF:C15H9BrClN
MW:318.595661878586
CID:1218127
PubChem ID:43668730
Update Time:2025-04-20
8-bromo-4-chloro-2-phenylquinoline Chemical and Physical Properties
Names and Identifiers
-
- 8-bromo-4-chloro-2-phenylquinoline
- CTK8G7314
- 4-Chloro-8-bromo-2-phenylquinoline
- DTXSID50656319
- MFCD11227076
- 125443-61-0
-
- Inchi： 1S/C15H9BrClN/c16-12-8-4-7-11-13(17)9-14(18-15(11)12)10-5-2-1-3-6-10/h1-9H
- InChI Key： SNHQTMXWTHIRCV-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC2=C(C=C(C3C=CC=CC=3)N=C21)Cl
Computed Properties
- Exact Mass: 316.96100
- Monoisotopic Mass: 316.96069g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 280
- 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: 5.2
- Topological Polar Surface Area: 12.9?2
Experimental Properties
- PSA: 12.89000
- LogP: 5.31770
8-bromo-4-chloro-2-phenylquinoline Related Literature
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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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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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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