| CAS Number | 1189106-09-9 |
| Catalog Number | AG0093JC(AGN-PC-0WR1PY) |
| Chemical Name | Ethyl 4,7-dichloroquinazoline-2-carboxylate |
| IUPAC Name | ethyl 4,7-dichloroquinazoline-2-carboxylate |
| InChI | InChI=1S/C11H8Cl2N2O2/c1-2-17-11(16)10-14-8-5-6(12)3-4-7(8)9(13)15-10/h3-5H,2H2,1H3 |
| InChI Key | SLYQQUNSFUMFFQ-UHFFFAOYSA-N |
| MDL Number | MFCD12675150 |
| Molecular Formula | C11H8Cl2N2O2 |
| Molecular Weight | 271.0994 |
| SMILES | CCOC(=O)c1nc2cc(Cl)ccc2c(n1)Cl |
| Synonyms | Ethyl 4,7-dichloroquinazoline-2-carboxylate,
1189106-09-9,
DTXSID10671245,
MFCD12675150,
ZINC36075761,
OR309399,
DB-061439,
Ethyl 4,7-dichloro-2-quinazolinecarboxylate,
T6240,
|
| Complexity | 291 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.996g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 271.097g/mol |
| Monoisotopic Mass | 269.996g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number