CAS 815-57-6|3-METHYL-2,4-PENTANEDIONE
Introduction：Basic information about CAS 815-57-6|3-METHYL-2,4-PENTANEDIONE, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-METHYL-2,4-PENTANEDIONE | ||
|---|---|---|---|
| CAS Number | 815-57-6 | Molecular Weight | 114.14200 |
| Density | 0.981 g/mL at 25 °C(lit.) | Boiling Point | 172-174 °C(lit.) |
| Molecular Formula | C6H10O2 | Melting Point | 190 - 191ºC |
| MSDS | ChineseUSA | Flash Point | 134 °F |
| Symbol | GHS02, GHS07 | Signal Word | Warning |
Names
| Name | 3-Methyl-2,4-pentanedione |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 0.981 g/mL at 25 °C(lit.) |
|---|---|
| Boiling Point | 172-174 °C(lit.) |
| Melting Point | 190 - 191ºC |
| Molecular Formula | C6H10O2 |
| Molecular Weight | 114.14200 |
| Flash Point | 134 °F |
| Exact Mass | 114.06800 |
| PSA | 34.14000 |
| LogP | 0.80050 |
| Index of Refraction | n20/D 1.442(lit.) |
| InChIKey | GSOHKPVFCOWKPU-UHFFFAOYSA-N |
| SMILES | CC(=O)C(C)C(C)=O |
Safety Information
| Symbol | GHS02, GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H226-H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Personal Protective Equipment | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xi: Irritant; |
| Risk Phrases | R36/37/38 |
| Safety Phrases | S26-S36/37/39 |
| RIDADR | UN 1224 3/PG 3 |
| WGK Germany | 3 |
| Packaging Group | III |
| Hazard Class | 3 |
| HS Code | 2914190090 |
Customs
| HS Code | 2914190090 |
|---|---|
| Summary | 2914190090 other acyclic ketones without other oxygen function。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0% |
Articles4
More Articles| Identifying chelators for metalloprotein inhibitors using a fragment-based approach. J. Med. Chem. 54 , 591-602, (2011) Fragment-based lead design (FBLD) has been used to identify new metal-binding groups for metalloenzyme inhibitors. When screened at 1 mM, a chelator fragment library (CFL-1.1) of 96 compounds produced... | |
| Chemiluminescent aldehyde and beta-diketone reactions promoted by peroxynitrite. Chem. Res. Toxicol. 13(5) , 317-26, (2000) Peroxynitrite is shown here to promote the aerobic oxidation of isobutanal (IBAL) and 3-methyl-2,4-pentanedione (MP) in a pH 7.2 phosphate buffer into acetone plus formate and biacetyl plus acetate, r... | |
| Rate coefficients for the reactions of OH radicals with the keto/enol tautomers of 2, 4-pentanedione and 3-methyl-2, 4-pentanedione, allyl alcohol and methyl vinyl ketone using the enols and methyl nitrite as photolytic sources of OH. Holloway A-L, et al. J. Photochem. Photobiol. A: Chem. 176(1) , 183-90, (2005) |
Synonyms
| 3-methylpentane-2,4-dione |
| EINECS 212-420-3 |
| MFCD00008762 |
