Cas no 62542-34-1 (3-Quinolinecarboxaldehyde, 2-methyl-, 1-oxide)
62542-34-1 structure
Product Name:3-Quinolinecarboxaldehyde, 2-methyl-, 1-oxide
CAS No:62542-34-1
MF:C11H7NO2
MW:185.178782701492
CID:440988
PubChem ID:11735571
Update Time:2025-04-19
3-Quinolinecarboxaldehyde, 2-methyl-, 1-oxide Chemical and Physical Properties
Names and Identifiers
-
- 3-Quinolinecarboxaldehyde, 2-methyl-, 1-oxide
- 2-methyl-1-oxidoquinolin-1-ium-3-carbaldehyde
- 62542-34-1
- SCHEMBL7891555
- DTXSID20471298
- 10222-53-4
- Quinoline-2,3-dicarbaldehyde
- 2,3-Quinolinedicarboxaldehyde
-
- Inchi： 1S/C11H7NO2/c13-6-9-5-8-3-1-2-4-10(8)12-11(9)7-14/h1-7H
- InChI Key： GITWZYLXJRXONX-UHFFFAOYSA-N
- SMILES： O=CC1=C(C=O)N=C2C=CC=CC2=C1
Computed Properties
- Exact Mass: 187.06337
- Monoisotopic Mass: 185.047678466g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 229
- 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: 1.4
- Topological Polar Surface Area: 47?2
Experimental Properties
- PSA: 44.01
3-Quinolinecarboxaldehyde, 2-methyl-, 1-oxide Related Literature
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1. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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