Isoquinoline-1-carboxylic acid
- Product NameIsoquinoline-1-carboxylic acid
- CAS486-73-7
- CBNumberCB9853667
- MFC10H7NO2
- MW173.17
- EINECS207-639-6
- MDL NumberMFCD00006901
- MOL File486-73-7.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 164 °C (dec.)(lit.) |
| Boiling point | 68-69 °C(lit.) |
| Density | 0.932 g/mL at 20 °C(lit.) |
| vapor density | 3.59 (vs air) |
| refractive index | n |
| Flash point | 8 °F |
| storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
| Water Solubility | Soluble in water |
| form | powder to crystal |
| pka | 1.09±0.10(Predicted) |
| color | Light orange to Yellow to Green |
| Merck | 13,9784 |
| BRN | 129177 |
| InChI | 1S/C10H7NO2/c12-10(13)9-8-4-2-1-3-7(8)5-6-11-9/h1-6H,(H,12,13) |
| InChIKey | XAAKCCMYRKZRAK-UHFFFAOYSA-N |
| SMILES | OC(=O)c1nccc2ccccc12 |
| CAS DataBase Reference | 486-73-7(CAS DataBase Reference) |
| FDA UNII | B8AHM99SW2 |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319-H335 | |||||||||
| Precautionary statements | P261-P280a-P304+P340-P305+P351+P338-P405-P501a | |||||||||
| Hazard Codes | Xn,Xi,T,F | |||||||||
| Risk Statements | 11-21-23/25-36/37/38-39/23/24/25-23/24/25-10 | |||||||||
| Safety Statements | 22-24/25-45-36/37/39-27-16-36-26-36/37-25-23 | |||||||||
| RIDADR | UN 2416 3/PG 2 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | ED5600000 | |||||||||
| F | 21 | |||||||||
| HazardClass | IRRITANT | |||||||||
| HS Code | 29334990 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| NFPA 704: |
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