4-(6-methoxy-3,4-dihydro-2H-1,3-benzoxazin-3-ium-3-yl)benzoate
4-(6-methoxy-2,4-dihydro-1,3-benzoxazin-3-yl)benzoic acid
Also Known As: Oprea1_174776|4-(6-methoxy-2,4-dihydro-1,3-benzoxazin-3-yl)benzoic acid|4-(6-methoxy-2H-benzo[e][1,3]oxazin-3(4H)-yl)benzoic acid|4-(6-methoxy-3,4-dihydro-2H-1,3-benzoxazin-3-ium-3-yl)benzoate|4-(3-methoxy-7-oxa-9-azabicyclo[4.4.0]deca-2,4,11-trien-9-yl)benzoic Acid
CAS: 333751-60-3
| Molecular Formula | C16H15NO4 |
|---|---|
| Molecular Weight | 285.1001 g/mol |
| LogP | 2.7499 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.1001 |
| Monoisotopic Mass | 285.1001 |
| Heavy Atoms | 21 |
| Complexity | 666.47723 |
Chemical Identifiers
| CAS Number | 333751-60-3 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)OCN(C2)C3=CC=C(C=C3)C(=O)O |
Product Overview
4-(6-methoxy-3,4-dihydro-2H-1,3-benzoxazin-3-ium-3-yl)benzoate (CAS 333751-60-3), with molecular formula C16H15NO4 and molecular weight 285.1001 g/mol. IUPAC: 4-(6-methoxy-2,4-dihydro-1,3-benzoxazin-3-yl)benzoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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4-(6-methoxy-3,4-dihydro-2H-1,3-benzoxazin-3-ium-3-yl)benzoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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