Cas no 115813-22-4 (3-bromo-7-chloroquinoline-8-carboxylic acid)
115813-22-4 structure
Product Name:3-bromo-7-chloroquinoline-8-carboxylic acid
CAS No:115813-22-4
MF:C10H5BrClNO2
MW:286.509200811386
CID:2613775
PubChem ID:14075413
Update Time:2025-04-21
3-bromo-7-chloroquinoline-8-carboxylic acid Chemical and Physical Properties
Names and Identifiers
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- 3-bromo-7-chloroquinoline-8-carboxylic acid
- 115813-22-4
- SCHEMBL9620423
- DTXSID10555516
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- Inchi： 1S/C10H5BrClNO2/c11-6-3-5-1-2-7(12)8(10(14)15)9(5)13-4-6/h1-4H,(H,14,15)
- InChI Key： NRDOVDIATCHYTO-UHFFFAOYSA-N
- SMILES： BrC1=CN=C2C(C(=O)O)=C(C=CC2=C1)Cl
Computed Properties
- Exact Mass: 284.91922Da
- Monoisotopic Mass: 284.91922Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 264
- 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
- Topological Polar Surface Area: 50.2?2
3-bromo-7-chloroquinoline-8-carboxylic acid Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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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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