HuagongsheHuagongshe Chemistry Print Report · For research reference only
7-Methyl-8-nitroquinoline
7-METHYL-8-NITROQUINOLINE · Quinoline, 7-methyl-8-nitro- · 7-Methyl-8-nitroquinoline>7-Methyl-8-nitroquinoline,98+% · 7-METHYL-8-NITROQUINOLINE 7471-63-8
Identifiers & Physical Properties
| CAS No. | 7471-63-8 |
|---|---|
| Molecular formula | C10H8N2O2 |
| Average molar mass | 188.18 g/mol |
| Monoisotopic mass | 188.0585775 g/mol |
| SMILES | Cc1ccc2cccnc2c1[N+](=O)[O-] |
| InChIKey | ZZDTVYJYMRSNQL-UHFFFAOYSA-N |
| PubChem CID | 81981 |
| ChEMBL | CHEMBL1668960 |
| EC No. | 231-268-9 |
| DTXSID | DTXSID80225693 |
Chemical & Physical Properties
| XLogP | 2.4 |
|---|---|
| Topological polar surface area | 58.7 |
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 3 |
| Rotatable bonds | 0 |
| Heavy atoms | 14 |
| Formal charge | 0 |
| Complexity | 227 |
| Kovats Retention Index | 1798.9305.75 |
| Melting point | 185-186°C |
| Boiling point | 330.5±27.0 °C(Predicted) |
| Density | 1.298±0.06 g/cm3(Predicted) |
| Storage conditions | Sealed in dry,Room Temperature |
| Solubility | Chlorform, Methanol (Slightly)Insoluble in water. |
| Physical state | Solid |
| pKa (acidity coefficient) | 1.71±0.31(Predicted) |
| Color | Off-White to Pale Yellow |
| BRN | 154601 |
| GHS pictogram | GHS07,GHS08 |
| Signal word | Warning |
| GHS hazard statements | H315-H319-H341 |
| GHS precautionary statements | P201-P202-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P308+P313-P405-P501-P501a |
| Risk statements (R) | 68 |
| Safety statements (S) | 22-36/37 |
| Customs code | 2933499090 |
Safety & Regulations
| GHS classification | WarningH315 (20%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (20%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H341 (80%): Suspected of causing genetic defects [Warning Germ cell mutagenicity]P203, P264, P264+P265, P280, P302+P352, P305+P351+P338, P318, P321, P332+P317, P337+P317, P362+P364, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website. |
|---|---|
| Hazard Classes and Categories | Skin Irrit. 2 (20%)Eye Irrit. 2 (20%) |
| Customs code | 2933499090 |
| Risk statements (R) | 68 |
| Signal word | Warning |
| GHS pictogram | GHS07,GHS08 |
| Safety statements (S) | 22-36/37 |
| GHS hazard statements | H315-H319-H341 |
| GHS precautionary statements | P201-P202-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P308+P313-P405-P501-P501a |
Applications & Uses
Uses
7-Methyl-8-nitroquinoline is used as a pharmaceutical intermediate.