CAS 597-49-9|3-Pentanol, 3-ethyl-
Introduction：Basic information about CAS 597-49-9|3-Pentanol, 3-ethyl-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-Pentanol, 3-ethyl- | ||
|---|---|---|---|
| CAS Number | 597-49-9 | Molecular Weight | 116.20100 |
| Density | 0.824 g/mL at 25 °C(lit.) | Boiling Point | 141 °C743 mm Hg(lit.) |
| Molecular Formula | C7H16O | Melting Point | -12.5 °C |
| MSDS | ChineseUSA | Flash Point | 104 °F |
| Symbol | GHS02, GHS05, GHS07 | Signal Word | Danger |
Names
| Name | 3-Ethyl-3-pentanol |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 0.824 g/mL at 25 °C(lit.) |
|---|---|
| Boiling Point | 141 °C743 mm Hg(lit.) |
| Melting Point | -12.5 °C |
| Molecular Formula | C7H16O |
| Molecular Weight | 116.20100 |
| Flash Point | 104 °F |
| Exact Mass | 116.12000 |
| PSA | 20.23000 |
| LogP | 1.94750 |
| Index of Refraction | n20/D 1.430(lit.) |
| InChIKey | XKIRHOWVQWCYBT-UHFFFAOYSA-N |
| SMILES | CCC(O)(CC)CC |
| Storage condition | Flammables area |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Subcutaneous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 700 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 5,161,1955
Safety Information
| Symbol | GHS02, GHS05, GHS07 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H226-H302-H315-H318-H335 |
| Precautionary Statements | P261-P280-P305 + P351 + P338 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xn |
| Risk Phrases | R10 |
| Safety Phrases | S16 |
| RIDADR | UN 1987 3/PG 3 |
| WGK Germany | 3 |
| RTECS | SA6780000 |
| Packaging Group | III |
| Hazard Class | 3 |
Articles3
More Articles| The effect of alcohol structures on the interaction mode with the hexameric capsule of resorcin[4]arene. Chemistry 18(27) , 8515-20, (2012) After more than a century of research on resorcin[4]arenes (1) it is clear that such systems form spontaneously [1(6)(H(2)O)(8)]-type hexameric capsules in wet, non-polar, organic solvents. However, t... | |
| Spectroscopic probing of the effect of alkanols on the properties of the head group region in reverse micelles of AOT-heptane-water. J. Colloid. Interface Sci. 258(2) , 363-6, (2003) The effects of addition of alkanols (ethanol, n-hexanol, and 3-ethyl-3-pentanol) on the micropolarity and microviscosity of the head group region in reverse micelles of AOT-heptane-water have been inv... | |
| New t-butyl based aspartate protecting groups preventing aspartimide formation in Fmoc SPPS. J. Pept. Sci. 21 , 680-7, (2015) Obtaining homogenous aspartyl-containing peptides via Fmoc/tBu chemistry is often an insurmountable obstacle. A generic solution for this issue utilising an optimised side-chain protection strategy th... |
Synonyms
| EINECS 209-902-0 |
| MFCD00021888 |
| 3-ethylpentan-3-ol |
