CAS 431-03-8|butane-2,3-dione
| Common Name | butane-2,3-dione | ||
|---|---|---|---|
| CAS Number | 431-03-8 | Molecular Weight | 86.089 |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 88.0±0.0 °C at 760 mmHg |
| Molecular Formula | C4H6O2 | Melting Point | -4--2 °C |
| MSDS | ChineseUSA | Flash Point | 7.2±0.0 °C |
| Symbol | GHS02, GHS05, GHS06 | Signal Word | Danger |
Names
| Name | butane-2,3-dione |
|---|---|
| Synonym | More Synonyms |
Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 88.0±0.0 °C at 760 mmHg |
| Melting Point | -4--2 °C |
| Molecular Formula | C4H6O2 |
| Molecular Weight | 86.089 |
| Flash Point | 7.2±0.0 °C |
| Exact Mass | 86.036781 |
| PSA | 34.14000 |
| LogP | -1.33 |
| Vapour density | 3 (vs air) |
| Vapour Pressure | 62.3±0.1 mmHg at 25°C |
| Index of Refraction | 1.381 |
| InChIKey | QSJXEFYPDANLFS-UHFFFAOYSA-N |
| SMILES | CC(=O)C(C)=O |
| Stability | Stable. Flammable. Incompatible with acids, strong bases, metals, reducing agents, oxidizing agents. Protect from moisture and water. Note low flashpoint. |
| Water Solubility | 200 g/L (20 ºC) |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1580 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Behavioral - convulsions or effect on seizure threshold
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 400 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold Behavioral - changes in motor activity (specific assay) Vascular - regional or general arteriolar or venous dilation
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- >5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - guinea pig
- DOSE/DURATION :
- 990 mg/kg
- TOXIC EFFECTS :
- Behavioral - ataxia Behavioral - coma Lungs, Thorax, or Respiration - dyspnea
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 48600 mg/kg/90D-I
- TOXIC EFFECTS :
- Liver - changes in liver weight Endocrine - changes in adrenal weight Blood - pigmented or nucleated red blood cells
MUTATION DATA - TEST SYSTEM :
- Rodent - rat
- DOSE/DURATION :
- 1500 mg/kg
- REFERENCE :
- JJCREP Japanese Journal of Cancer Research. (Elsevier Science Pub. BV, POB 211, 1000 AE Amsterdam, Netherlands) V.76- 1985- Volume(issue)/page/year: 76,809,1985 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 84595 No. of Facilities: 126 (estimated) No. of Industries: 3 No. of Occupations: 6 No. of Employees: 1503 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 84595 No. of Facilities: 185 (estimated) No. of Industries: 3 No. of Occupations: 13 No. of Employees: 3438 (estimated) No. of Female Employees: 1628 (estimated)
- TEST SYSTEM :
- Rodent - rat
- DOSE/DURATION :
- 1500 mg/kg
- REFERENCE :
- JJCREP Japanese Journal of Cancer Research. (Elsevier Science Pub. BV, POB 211, 1000 AE Amsterdam, Netherlands) V.76- 1985- Volume(issue)/page/year: 76,809,1985 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 84595 No. of Facilities: 126 (estimated) No. of Industries: 3 No. of Occupations: 6 No. of Employees: 1503 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 84595 No. of Facilities: 185 (estimated) No. of Industries: 3 No. of Occupations: 13 No. of Employees: 3438 (estimated) No. of Female Employees: 1628 (estimated)
Safety Information
| Symbol | GHS02, GHS05, GHS06 |
|---|---|
| Signal Word | Danger |
| Hazard Statements | H225-H302-H315-H318-H331-H335 |
| Precautionary Statements | P210-P261-P280-P305 + P351 + P338-P311 |
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;Heavyweight Gloves;multi-purpose combination respirator cartridge (US);Safety Clothing;type ABEK (EN14387) respirator filter |
| Hazard Codes | F:Flammable |
| Risk Phrases | R11;R20/21/22;R36/38 |
| Safety Phrases | S9-S16-S26-S37/39-S36/37/39-S39 |
| RIDADR | UN 2346 3/PG 2 |
| WGK Germany | 2 |
| RTECS | EK2625000 |
| Packaging Group | II |
| 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% |
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Synonyms
| butanedione |
| MFCD00008756 |
| 2,3-Butanedione |
| Butan-2,3-dione |
| EINECS 207-069-8 |
| 2,3-butandione |
| 2,3-Butadione |
| Butane-2,3-dione |
| Biacetyl |
| Dimethylglyoxal |
| 2,3-Diketobutane |
| Diacetyl |
