n-Butyl cyanoacetate
- Product Namen-Butyl cyanoacetate
- CAS5459-58-5
- CBNumberCB9377398
- MFC7H11NO2
- MW141.17
- EINECS226-730-1
- MDL NumberMFCD00001941
- MOL File5459-58-5.mol
- MSDS FileSDS
Chemical Properties
| Boiling point | 230.7 °C |
| Density | 1 |
| refractive index | n |
| Flash point | 189 °F |
| storage temp. | 2-8°C |
| pka | 3.06±0.10(Predicted) |
| form | clear liquid |
| color | APHA: ≤60 |
| Water Solubility | IMMISCIBLE |
| InChI | InChI=1S/C7H11NO2/c1-2-3-6-10-7(9)4-5-8/h2-4,6H2,1H3 |
| InChIKey | DJACTCNGCHPGOI-UHFFFAOYSA-N |
| SMILES | C(OCCCC)(=O)CC#N |
| CAS DataBase Reference | 5459-58-5(CAS DataBase Reference) |
| EWG's Food Scores | 1 |
| FDA UNII | F9H6L20VOH |
| NIST Chemistry Reference | n-Butyl cyanoacetate(5459-58-5) |
| EPA Substance Registry System | Acetic acid, cyano-, butyl ester (5459-58-5) |
| UNSPSC Code | 12352100 |
Safety
| Symbol(GHS) |
|
|||||||||
| Signal word | Warning | |||||||||
| Hazard statements | H312+H332-H315-H319-H335 | |||||||||
| Precautionary statements | P280-P302+P352+P312-P304+P340+P312-P305+P351+P338 | |||||||||
| Hazard Codes | Xn | |||||||||
| Risk Statements | 20/21/22-36/37/38 | |||||||||
| Safety Statements | 26-27-36/37/39 | |||||||||
| RIDADR | UN 3276 6.1/PG 3 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | AG3692500 | |||||||||
| TSCA | TSCA listed | |||||||||
| PackingGroup | III | |||||||||
| HS Code | 29269090 | |||||||||
| Storage Class | 10 - Combustible liquids | |||||||||
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 | |||||||||
| NFPA 704: |
|
