CAS 3128-07-2|6-Oxoheptanoic acid
Introduction：Basic information about CAS 3128-07-2|6-Oxoheptanoic acid, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 6-Oxoheptanoic acid | ||
|---|---|---|---|
| CAS Number | 3128-07-2 | Molecular Weight | 144.168 |
| Density | 1.1±0.1 g/cm3 | Boiling Point | 299.3±23.0 °C at 760 mmHg |
| Molecular Formula | C7H12O3 | Melting Point | 35-37 °C(lit.) |
| MSDS | ChineseUSA | Flash Point | 149.1±19.1 °C |
| Symbol | GHS05 | Signal Word | Danger |
Names
| Name | 6-oxoheptanoic acid |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.1±0.1 g/cm3 |
|---|---|
| Boiling Point | 299.3±23.0 °C at 760 mmHg |
| Melting Point | 35-37 °C(lit.) |
| Molecular Formula | C7H12O3 |
| Molecular Weight | 144.168 |
| Flash Point | 149.1±19.1 °C |
| Exact Mass | 144.078644 |
| PSA | 54.37000 |
| LogP | 0.17 |
| Vapour Pressure | 0.0±1.3 mmHg at 25°C |
| Index of Refraction | 1.444 |
| InChIKey | IZOQMUVIDMLRDC-UHFFFAOYSA-N |
| SMILES | CC(=O)CCCCC(=O)O |
Safety Information
| Symbol | GHS05 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H314 |
| Precautionary Statements | P280-P305 + P351 + P338-P310 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face particle respirator type N100 (US);Gloves;respirator cartridge type N100 (US);type P1 (EN143) respirator filter;type P3 (EN 143) respirator cartridges |
| Hazard Codes | C: Corrosive; |
| Risk Phrases | R34 |
| Safety Phrases | S26-S36/37/39-S45 |
| RIDADR | UN 3261 8/PG 2 |
| WGK Germany | 3 |
| Packaging Group | III |
| Hazard Class | 8 |
| HS Code | 2918300090 |
Customs
| HS Code | 2918300090 |
|---|---|
| Summary | 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0% |
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| Mass spectrometric characterization of small oxocarboxylic acids and gas phase ion fragmentation mechanisms studied by electrospray triple quadrupole-MS/MS-TOF system and DFT theory.Kanawati B, et al. Int. J. Mass Spectrom. 266(1) , 97-113, (2007) |
Synonyms
| 6-Oxoheptanoic acid |
| EINECS 221-512-2 |
| 5-aceto valeric acid |
| Heptanoic acid,6-oxo |
| 6-oxyheptanoic acid |
| 6-oxo-heptanoic acid |
| 6-Oxoenanthic acid |
| 5-Acetylpentanoic acid |
| Heptanoic acid, 6-oxo- |
| 5-Acetylvaleric Acid |
| 6-ketoheptanoic acid |
| MFCD00051479 |
