Introduction：Basic information about CAS 540-42-1|Isobutyl propionate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Isobutyl propionate |
|---|
| CAS Number | 540-42-1 | Molecular Weight | 130.185 |
|---|
| Density | 0.9±0.1 g/cm3 | Boiling Point | 135.1±8.0 °C at 760 mmHg |
|---|
| Molecular Formula | C7H14O2 | Melting Point | −71 °C(lit.) |
|---|
| MSDS | ChineseUSA | Flash Point | 26.1±0.0 °C |
|---|
| Symbol |
GHS02 | Signal Word | Warning |
|---|
Names
| Name | Isobutyl propionate |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 0.9±0.1 g/cm3 |
|---|
| Boiling Point | 135.1±8.0 °C at 760 mmHg |
|---|
| Melting Point | −71 °C(lit.) |
|---|
| Molecular Formula | C7H14O2 |
|---|
| Molecular Weight | 130.185 |
|---|
| Flash Point | 26.1±0.0 °C |
|---|
| Exact Mass | 130.099380 |
|---|
| PSA | 26.30000 |
|---|
| LogP | 2.12 |
|---|
| Vapour Pressure | 7.9±0.2 mmHg at 25°C |
|---|
| Index of Refraction | 1.404 |
|---|
| InChIKey | FZXRXKLUIMKDEL-UHFFFAOYSA-N |
|---|
| SMILES | CCC(=O)OCC(C)C |
|---|
Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- UF4930000
- CHEMICAL NAME :
- Propionic acid, isobutyl ester
- CAS REGISTRY NUMBER :
- 540-42-1
- BEILSTEIN REFERENCE NO. :
- 1745554
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C7-H14-O2
- MOLECULAR WEIGHT :
- 130.21
- WISWESSER LINE NOTATION :
- 2VO1Y1&1
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rabbit
- DOSE/DURATION :
- 5599 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- IMSUAI Industrial Medicine and Surgery. (Northbrook, IL) V.18-42, 1949-73. For publisher information, see IOHSA5. Volume(issue)/page/year: 41,31,1972
|
Safety Information
| Symbol |
GHS02 |
|---|
| Signal Word | Warning |
|---|
| Hazard Statements | H226 |
|---|
| Personal Protective Equipment | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
|---|
| Risk Phrases | R10 |
|---|
| Safety Phrases | S16 |
|---|
| RIDADR | UN 2394 3/PG 3 |
|---|
| WGK Germany | 2 |
|---|
| RTECS | UF4930000 |
|---|
| Packaging Group | III |
|---|
| Hazard Class | 3.2 |
|---|
| HS Code | 2915509000 |
|---|
Customs
| HS Code | 2915509000 |
|---|
| Summary | 2915509000 propionic acid, its salts and esters。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:5.5%。general tariff:30.0% |
|---|
Articles2
More Articles
| Mosciano, G. Perfum. Flavor. 2nd ed., 24 , 51, (1999)
| |
| Catalysis by heteropoly compounds. XXII. Reactions of esters and esterification catalyzed by heteropolyacids in a homogeneous liquid-phase effects of the central atom of heteropolyanions having tungsten as the addenda atom. J. Catal. 143(2) , 437-448, (1993)
| |
Synonyms
| EINECS 208-746-0 |
| Isobutyl propionate |
| MFCD00009307 |
| Propanoic acid, 2-methylpropyl ester |
| Propionic Acid Isobutyl Ester |
| 2-methylpropyl propanoate |
