Cas no 918518-83-9 (Quinoline, 5-bromo-2-methoxy-3-(phenylmethyl)-)
918518-83-9 structure
Product Name:Quinoline, 5-bromo-2-methoxy-3-(phenylmethyl)-
CAS No:918518-83-9
MF:C17H14BrNO
MW:328.20316362381
CID:773915
PubChem ID:59200493
Update Time:2025-04-19
Quinoline, 5-bromo-2-methoxy-3-(phenylmethyl)- Chemical and Physical Properties
Names and Identifiers
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- Quinoline, 5-bromo-2-methoxy-3-(phenylmethyl)-
- 3-benzyl-5-bromo-2-methoxyquinoline
- CS-0011152
- 918518-83-9
- DTXSID00731241
- SCHEMBL13227179
- FT-0702586
-
- Inchi： 1S/C17H14BrNO/c1-20-17-13(10-12-6-3-2-4-7-12)11-14-15(18)8-5-9-16(14)19-17/h2-9,11H,10H2,1H3
- InChI Key： ASUNDMLNVNFWMS-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC2C1=CC(=C(N=2)OC)CC1C=CC=CC=1
Computed Properties
- Exact Mass: 327.02588g/mol
- Monoisotopic Mass: 327.02588g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- Complexity: 305
- 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: 5.1
- Topological Polar Surface Area: 22.1?2
Quinoline, 5-bromo-2-methoxy-3-(phenylmethyl)- Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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3. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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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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