4-Methyl-1-pentanol
- Product Name4-Methyl-1-pentanol
- CAS626-89-1
- CBNumberCB5776364
- MFC6H14O
- MW102.17
- EINECS210-969-3
- MDL NumberMFCD00002962
- MOL File626-89-1.mol
Chemical Properties
| Melting point: | -48.42°C (estimate) |
| Boiling point: | 160-165 °C (lit.) |
| Density | 0.821 g/mL at 25 °C (lit.) |
| refractive index | n |
| Flash point: | 125 °F |
| storage temp. | Sealed in dry,Room Temperature |
| solubility | DMF: 50 mg/mL; DMSO: 50 mg/mL; Ethanol: 50 mg/mL; PBS (pH 7.2): 1.4 mg/mL |
| form | clear liquid |
| pka | 15.21±0.10(Predicted) |
| color | Colorless to Almost colorless |
| Odor | nutty |
| Water Solubility | 10.42g/L(20 ºC) |
| BRN | 1731303 |
| InChI | 1S/C6H14O/c1-6(2)4-3-5-7/h6-7H,3-5H2,1-2H3 |
| InChIKey | PCWGTDULNUVNBN-UHFFFAOYSA-N |
| SMILES | CC(C)CCCO |
| LogP | 1.702 (est) |
| CAS DataBase Reference | 626-89-1(CAS DataBase Reference) |
| NIST Chemistry Reference | 1-Pentanol, 4-methyl-(626-89-1) |
Safety
| Symbol(GHS) |
 GHS02 |
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| Signal word | Warning | |||||||||
| Hazard statements | H302-H226 | |||||||||
| Precautionary statements | P501-P270-P240-P210-P233-P243-P241-P242-P264-P280-P370+P378-P303+P361+P353-P301+P312+P330-P403+P235 | |||||||||
| PPE | Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 10-37 | |||||||||
| Safety Statements | 24/25-16 | |||||||||
| RIDADR | UN 1987 3/PG 3 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | NR3020000 | |||||||||
| HS Code | 2905.19.9090 | |||||||||
| HazardClass | 3.2 | |||||||||
| PackingGroup | III | |||||||||
| Storage Class | 3 - Flammable liquids | |||||||||
| Hazard Classifications | Flam. Liq. 3 | |||||||||
| NFPA 704: |
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