4-((4-bromo-2-fluorophenyl)amino)-7-methoxyquinazolin-6-yl acetate
Product Specifications
- CAS
- 808762-62-1
- MF
- C17H13BrFN3O3
- Appearance
- yellow to off-white solid
- Synonym(s)
- 6-Quinazolinol, 4-[(4-bromo-2-fluorophenyl)amino]-7-methoxy-, 6-acetate
- Shipping
- ambient temperature
- Storage
- 2-8°C
4-((4-bromo-2-fluorophenyl)amino)-7-methoxyquinazolin-6-yl acetate corresponds to CAS 808762-62-1, formula C17H13BrFN3O3, and molecular weight 406.2. The CAS resolves to one PubChem compound, CID 21098397. PubChem records SMILES CC(=O)OC1=C(C=C2C(=C1)C(=NC=N2)NC3=C(C=C(C=C3)Br)F)OC and InChIKey MBMMHAKZDRAOJV-UHFFFAOYSA-N for the verified graph. It is a single molecular component.
The quinazoline ring carries an amino-linked phenyl group at position 4. On that phenyl ring, fluorine is ortho and bromine para to the amino connection. Methoxy occupies quinazoline position 7, while the oxygen at position 6 is bonded to an acetyl group, giving the quinazolin-6-yl acetate description. That acetate contributes two carbons and two oxygens beyond the methoxy oxygen. This attachment is different from a free 6-hydroxy group, and the distinction is encoded by both the CAS-specific graph and the longer SMILES.
A compound-specific inquiry should provide Rlavie with CAS 808762-62-1, the full name including “acetate,” and the requested quantity. Attach a MOL or SDF structure file so the acetate bond, 7-methoxy group, amino bridge, and 2-fluoro/4-bromo placements can be checked against PubChem CID 21098397 and InChIKey MBMMHAKZDRAOJV-UHFFFAOYSA-N. Rlavie can compare these references before reviewing request-specific details. The acetate record must not be conflated with the related 6-ol identity: the additional acetyl fragment changes formula, molecular weight, CAS, CID, and connectivity even though much of the ring framework is shared.