| CAS Number | 86110-26-1 |
| Catalog Number | AG00H3DN(AGN-PC-00LZVW) |
| Chemical Name | 4-CHloro-Imidazo[1,5-A]Quinoxaline-3-Carboxylic Acid Ethyl Ester |
| IUPAC Name | ethyl 4-chloroimidazo[1,5-a]quinoxaline-3-carboxylate |
| InChI | InChI=1S/C13H10ClN3O2/c1-2-19-13(18)10-11-12(14)16-8-5-3-4-6-9(8)17(11)7-15-10/h3-7H,2H2,1H3 |
| InChI Key | OIHQPMNWYTYQTA-UHFFFAOYSA-N |
| MDL Number | MFCD12198779 |
| Molecular Formula | C13H10ClN3O2 |
| Molecular Weight | 275.6904 |
| SMILES | CCOC(=O)c1ncn2c1c(Cl)nc1ccccc21 |
| Synonyms | 86110-26-1,
ethyl 4-chloroimidazo[1,5-a]quinoxaline-3-carboxylate,
4-Chloro-Imidazo[1,5-A]Quinoxaline-3-Carboxylic Acid Ethyl Ester,
SCHEMBL11082707,
OIHQPMNWYTYQTA-UHFFFAOYSA-N,
MFCD12198779,
ZINC39594350,
AM805238,
CS-0037759,
FT-0763959,
4-Chloro-imidazo[1,5-a]quinoxaline-3-carboxylicacidethylester,
4-chloroimidazo [1,5-a]quinoxaline 3-carboxylic acid ethyl ester,
4-Chloroimidazo[1,5-a]quinoxaline 3-carboxylic acid ethyl ester,
4-Chloroimidazo[1,5-a]quinoxaline-3-carboxylic acid ethyl ester,
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| Complexity | 355 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 275.046g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 275.692g/mol |
| Monoisotopic Mass | 275.046g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 56.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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