Cas no 54132-35-3 (3-QUINOLINECARBOXYLIC ACID, 7-CHLORO-1,4-DIHYDRO-4-OXO-, ETHYL ESTER)
54132-35-3 structure
Product Name:3-QUINOLINECARBOXYLIC ACID, 7-CHLORO-1,4-DIHYDRO-4-OXO-, ETHYL ESTER
CAS No:54132-35-3
MF:C12H10ClNO3
MW:251.665702342987
CID:3301039
PubChem ID:345422
Update Time:2025-04-21
3-QUINOLINECARBOXYLIC ACID, 7-CHLORO-1,4-DIHYDRO-4-OXO-, ETHYL ESTER Chemical and Physical Properties
Names and Identifiers
-
- 3-QUINOLINECARBOXYLIC ACID, 7-CHLORO-1,4-DIHYDRO-4-OXO-, ETHYL ESTER
- ethyl 6-chloro-1,4-dihydro-4-oxo-3-quinolinecarboxylate
- 7-chloro-4-hydroxyquinoline-3-carboxylic acid, ethyl ester
- AKOS005175419
- 7-CHLORO-4-HYDROXY-QUINOLINE-3-CARBOXYLIC ACID METHYL ESTER
- BS-49470
- AE-641/04241025
- ethyl 7-chloro-1,4-dihydro-4-oxoquinoline-3-carboxylate
- MFCD00438741
- 7-Chloro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid ethyl ester
- ALBB-035213
- 7-Chloro-4-hydroxy-3-quinolinecarboxylic acid, ethyl ester
- 54132-35-3
- STL471335
- DB-064598
- 7-chloro-4-hydroxy-quinoline-3-carboxylic acid ethyl ester
- SY279297
- NSC403048
- 3-Quinolinecarboxylic acid, 7-chloro-4-hydroxy-, ethyl ester
- ethyl7-chloro-4-hydroxyquinoline-3-carboxylate
- ethyl 7-chloro-4-hydroxyquinoline-3-carboxylate
- DTXSID80323108
- NSC-403048
- CS-0120622
- ethyl 7-chloro-4-hydroxy-quinoline-3-carboxylate
- SCHEMBL1178859
- ethyl 7-chloro-4-hydroxy-3-quinoline-carboxylate
- SB72089
- D82227
- Ethyl 7-chloro-4-hydroxy-3-quinolinecarboxylate
- 7-chloro-3-ethoxycarbonyl-4(1H)-quinolone
- ethyl 7-chloro-4-oxo-1H-quinoline-3-carboxylate
- 16600-22-9
- Ethyl 7-chloro-4-oxo-1,4-dihydroquinoline-3-carboxylate
-
- Inchi： 1S/C12H10ClNO3/c1-2-17-12(16)9-6-14-10-5-7(13)3-4-8(10)11(9)15/h3-6H,2H2,1H3,(H,14,15)
- InChI Key： XWMCHSWUDMFGSW-UHFFFAOYSA-N
- SMILES： N1C2=C(C=CC(Cl)=C2)C(=O)C(C(OCC)=O)=C1
Computed Properties
- Exact Mass: 251.0349209Da
- Monoisotopic Mass: 251.0349209Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 367
- 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: 2.6
- Topological Polar Surface Area: 55.4?2
3-QUINOLINECARBOXYLIC ACID, 7-CHLORO-1,4-DIHYDRO-4-OXO-, ETHYL ESTER Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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