m-Toluic acid, 7-nitro-8-quinolyl ester
(7-nitroquinolin-8-yl) 3-methylbenzoate
Also Known As: 7-Nitro-8-quinolyl m-toluate|8-Quinolinol, 7-nitro-, m-toluate|m-Toluic acid, 7-nitro-8-quinolyl ester|Benzoic acid, 3-methyl-, 7-nitro-8-quinolyl ester|m-Toluic acid 7-nitro-8-quinolyl ester|(7-nitroquinolin-8-yl) 3-methylbenzoate|7-NITROQUINOLIN-8-YL 3-METHYLBENZOATE
CAS: 29007-00-9
| Molecular Formula | C17H12N2O4 |
|---|---|
| Molecular Weight | 308.0797 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 85.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.0797 |
| Monoisotopic Mass | 308.0797 |
| Heavy Atoms | 23 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 29007-00-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)OC2=C(C=CC3=C2N=CC=C3)[N+](=O)[O-] |
| InChIKey | SPKSUGVDJKSMRI-UHFFFAOYSA-N |
Product Overview
m-Toluic acid, 7-nitro-8-quinolyl ester (CAS 29007-00-9), with molecular formula C17H12N2O4 and molecular weight 308.0797 g/mol. IUPAC: (7-nitroquinolin-8-yl) 3-methylbenzoate.
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.
View MSDS →
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