| CAS Number | 1607787-61-0 |
| Catalog Number | AG001VBU(AGN-PC-0WG406) |
| Chemical Name | Methyl quinazoline-2-carboxylate |
| IUPAC Name | methyl quinazoline-2-carboxylate |
| InChI | InChI=1S/C10H8N2O2/c1-14-10(13)9-11-6-7-4-2-3-5-8(7)12-9/h2-6H,1H3 |
| InChI Key | RXEQRGJSVWMYBS-UHFFFAOYSA-N |
| MDL Number | MFCD28991801 |
| Molecular Formula | C10H8N2O2 |
| Molecular Weight | 188.1827 |
| SMILES | COC(=O)C1=NC2=CC=CC=C2C=N1 |
| Synonyms | Methyl quinazoline-2-carboxylate,
1607787-61-0,
SCHEMBL15655786,
MFCD28991801,
AKOS027255657,
ZINC224681984,
AS-54890,
2-Quinazolinecarboxylic acid, methyl ester,
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| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.186g/mol |
| Monoisotopic Mass | 188.059g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 52.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number