Cas no 177554-01-7 (4-Quinolinecarboxylic acid, 2-(2-carboxyphenyl)-6-methyl-3-phenyl-)
177554-01-7 structure
Product Name:4-Quinolinecarboxylic acid, 2-(2-carboxyphenyl)-6-methyl-3-phenyl-
CAS No:177554-01-7
MF:C24H17NO4
MW:383.396086454391
CID:1364178
Update Time:2024-08-14
4-Quinolinecarboxylic acid, 2-(2-carboxyphenyl)-6-methyl-3-phenyl- Chemical and Physical Properties
Names and Identifiers
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- 4-Quinolinecarboxylic acid, 2-(2-carboxyphenyl)-6-methyl-3-phenyl-
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- Inchi： 1S/C24H17NO4/c1-14-11-12-19-18(13-14)21(24(28)29)20(15-7-3-2-4-8-15)22(25-19)16-9-5-6-10-17(16)23(26)27/h2-13H,1H3,(H,26,27)(H,28,29)
- InChI Key： MHKVLWYRGNDJSL-UHFFFAOYSA-N
- SMILES： N1C2C(=CC(C)=CC=2)C(C(O)=O)=C(C2=CC=CC=C2)C=1C1=CC=CC=C1C(O)=O
Computed Properties
- Exact Mass: 383.11581
Experimental Properties
- Density: 1.328±0.06 g/cm3(Predicted)
- Boiling Point: 534.7±50.0 °C(Predicted)
- PSA: 87.49
- pka: 0.81±0.30(Predicted)
4-Quinolinecarboxylic acid, 2-(2-carboxyphenyl)-6-methyl-3-phenyl- Related Literature
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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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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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
177554-01-7 (4-Quinolinecarboxylic acid, 2-(2-carboxyphenyl)-6-methyl-3-phenyl-) Related Products
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