Cas no 81124-46-1 (2-Propenoic acid, 3-(2-quinolinyl)-, methyl ester, (2E)-)
81124-46-1 structure
Product Name:2-Propenoic acid, 3-(2-quinolinyl)-, methyl ester, (2E)-
CAS No:81124-46-1
MF:C13H11NO2
MW:213.231943368912
CID:704490
PubChem ID:513392
Update Time:2025-04-19
2-Propenoic acid, 3-(2-quinolinyl)-, methyl ester, (2E)- Chemical and Physical Properties
Names and Identifiers
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- 2-Propenoic acid, 3-(2-quinolinyl)-, methyl ester, (2E)-
- methyl 3-quinolin-2-ylprop-2-enoate
- DTXSID70333599
- JZHPAMDTRMIGJP-UHFFFAOYSA-N
- 3-(quinolin-2-yl)acrylic acid methyl ester
- Methyl (E)-3-(2-quinolinyl)-2-propenoate
- 81124-46-1
-
- Inchi： 1S/C13H11NO2/c1-16-13(15)9-8-11-7-6-10-4-2-3-5-12(10)14-11/h2-9H,1H3
- InChI Key： JZHPAMDTRMIGJP-UHFFFAOYSA-N
- SMILES： O(C)C(C=CC1=CC=C2C=CC=CC2=N1)=O
Computed Properties
- Exact Mass: 213.078978594g/mol
- Monoisotopic Mass: 213.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 275
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 2.5
- Topological Polar Surface Area: 39.2?2
2-Propenoic acid, 3-(2-quinolinyl)-, methyl ester, (2E)- Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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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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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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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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