Cas no 67080-45-9 (3-Cinnolinecarboxylic acid, ethyl ester)
67080-45-9 structure
Product Name:3-Cinnolinecarboxylic acid, ethyl ester
CAS No:67080-45-9
MF:C11H10N2O2
MW:202.209302425385
CID:1713758
PubChem ID:12422073
Update Time:2025-09-18
3-Cinnolinecarboxylic acid, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 3-Cinnolinecarboxylic acid, ethyl ester
- ethyl cinnoline-3-carboxylate
- MFCD29051923
- NS-02077
- ethylcinnoline-3-carboxylate
- AKOS025143358
- ethyl 3-cinnolinecarboxylate
- cinnoline-3-carboxylic acid ethyl ester
- 67080-45-9
- SCHEMBL8830040
- DTXSID10497503
- (ethoxycarbonyl)cinnoline
-
- Inchi： 1S/C11H10N2O2/c1-2-15-11(14)10-7-8-5-3-4-6-9(8)12-13-10/h3-7H,2H2,1H3
- InChI Key： PNBGALCIMPLCTA-UHFFFAOYSA-N
- SMILES： O(CC)C(C1=CC2C=CC=CC=2N=N1)=O
Computed Properties
- Exact Mass: 202.0743
- Monoisotopic Mass: 202.074227566g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 233
- 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: 1.5
- Topological Polar Surface Area: 52.1?2
Experimental Properties
- PSA: 52.08
3-Cinnolinecarboxylic acid, ethyl ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Ambeed | A884472-1g |
Ethyl cinnoline-3-carboxylate |
67080-45-9 | 97% | 1g |
$644.0 | 2025-04-17 |
3-Cinnolinecarboxylic acid, ethyl ester Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
-
L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
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