Cas no 5093-81-2 (8-Quinolinecarboxylic acid, 2-phenyl-)
5093-81-2 structure
Product Name:8-Quinolinecarboxylic acid, 2-phenyl-
CAS No:5093-81-2
MF:C16H11NO2
MW:249.264044046402
CID:363732
PubChem ID:14068993
Update Time:2025-04-19
8-Quinolinecarboxylic acid, 2-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 8-Quinolinecarboxylic acid, 2-phenyl-
- 2-phenylquinoline-8-carboxylic acid
- 8-quinolinecarboxylic acid,2-phenyl-
- DTXSID90555372
- 5093-81-2
- SCHEMBL1033211
- KJLNRZNBAGSKBP-UHFFFAOYSA-N
-
- Inchi： 1S/C16H11NO2/c18-16(19)13-8-4-7-12-9-10-14(17-15(12)13)11-5-2-1-3-6-11/h1-10H,(H,18,19)
- InChI Key： KJLNRZNBAGSKBP-UHFFFAOYSA-N
- SMILES： OC(C1=CC=CC2=CC=C(C3C=CC=CC=3)N=C21)=O
Computed Properties
- Exact Mass: 249.07903
- Monoisotopic Mass: 249.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 325
- 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: 3.4
- Topological Polar Surface Area: 50.2?2
Experimental Properties
- PSA: 50.19
8-Quinolinecarboxylic acid, 2-phenyl- Related Literature
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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