Isonipecotic acid
- Product NameIsonipecotic acid
- CAS498-94-2
- CBNumberCB7426775
- MFC6H11NO2
- MW129.16
- EINECS207-872-3
- MDL NumberMFCD00006004
- MOL File498-94-2.mol
- MSDS FileSDS
Chemical Properties
| Melting point | >300 °C(lit.) |
| Boiling point | 239.22°C (rough estimate) |
| Density | 1.1426 (rough estimate) |
| refractive index | 1.4587 (estimate) |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| solubility | Water |
| pka | pK1:3.73(+1);pK2:10.72(0) (25°C) |
| form | Powder |
| color | White to faint pink-beige |
| Water Solubility | soluble |
| Merck | 14,5189 |
| BRN | 112553 |
| InChI | InChI=1S/C6H11NO2/c8-6(9)5-1-3-7-4-2-5/h5,7H,1-4H2,(H,8,9) |
| InChIKey | SRJOCJYGOFTFLH-UHFFFAOYSA-N |
| SMILES | N1CCC(C(O)=O)CC1 |
| CAS DataBase Reference | 498-94-2(CAS DataBase Reference) |
| EWG's Food Scores | 1 |
| FDA UNII | M5TZP1RWIE |
Safety
| Symbol(GHS) |
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| Signal word | Warning | |||||||||
| Hazard statements | H315-H319-H335 | |||||||||
| Precautionary statements | P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362+P364-P403+P233-P501c | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36/37/38 | |||||||||
| Safety Statements | 26-36-37/39 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | NS5150000 | |||||||||
| TSCA | TSCA listed | |||||||||
| HazardClass | IRRITANT | |||||||||
| HS Code | 29333999 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| NFPA 704: |
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