Cas no 138891-57-3 (Imidazo[1,5-a]pyridine-1-carboxylic acid, 3-methyl-, ethyl ester)
![Imidazo[1,5-a]pyridine-1-carboxylic acid, 3-methyl-, ethyl ester structure](https://ossimg.kuujia.com/scimg/139000/138891-57-3x500.png)
138891-57-3 structure
Product Name:Imidazo[1,5-a]pyridine-1-carboxylic acid, 3-methyl-, ethyl ester
CAS No:138891-57-3
MF:C11H12N2O2
MW:204.225182533264
CID:3723538
PubChem ID:15169596
Update Time:2025-04-22
Imidazo[1,5-a]pyridine-1-carboxylic acid, 3-methyl-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Imidazo[1,5-a]pyridine-1-carboxylic acid, 3-methyl-, ethyl ester
- 138891-57-3
- DB-204718
- 3-Methylimidazo[1,5-a]pyridine-1-carboxylic acid ethyl ester
-
- Inchi： 1S/C11H12N2O2/c1-3-15-11(14)10-9-6-4-5-7-13(9)8(2)12-10/h4-7H,3H2,1-2H3
- InChI Key： WZOFDOYMFCZZJU-UHFFFAOYSA-N
- SMILES： C12=C(C(OCC)=O)N=C(C)N1C=CC=C2
Computed Properties
- Exact Mass: 204.089877630Da
- Monoisotopic Mass: 204.089877630Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 245
- 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: 2.8
- Topological Polar Surface Area: 43.6?2
Imidazo[1,5-a]pyridine-1-carboxylic acid, 3-methyl-, ethyl ester Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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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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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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