Introduction：Basic information about CAS 7774-65-4|terpinyl isobutyrate, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | terpinyl isobutyrate |
|---|
| CAS Number | 7774-65-4 | Molecular Weight | 224.33900 |
|---|
| Density | 0.943 g/mL at 25ºC(lit.) | Boiling Point | 272.5ºC at 760 mmHg |
|---|
| Molecular Formula | C14H24O2 | Melting Point | 132ºC |
|---|
| MSDS | USA | Flash Point | 85.6ºC |
|---|
Names
| Name | 2-(4-methylcyclohex-3-en-1-yl)propan-2-yl 2-methylpropanoate |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 0.943 g/mL at 25ºC(lit.) |
|---|
| Boiling Point | 272.5ºC at 760 mmHg |
|---|
| Melting Point | 132ºC |
|---|
| Molecular Formula | C14H24O2 |
|---|
| Molecular Weight | 224.33900 |
|---|
| Flash Point | 85.6ºC |
|---|
| Exact Mass | 224.17800 |
|---|
| PSA | 26.30000 |
|---|
| LogP | 3.71060 |
|---|
| Index of Refraction | n20/D 1.461(lit.) |
|---|
| InChIKey | SMQUXKIIXFOJKI-UHFFFAOYSA-N |
|---|
| SMILES | CC1=CCC(C(C)(C)OC(=O)C(C)C)CC1 |
|---|
Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- UA2470450
- CHEMICAL NAME :
- Propanoic acid, 2-methyl-, 1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl ester
- CAS REGISTRY NUMBER :
- 7774-65-4
- BEILSTEIN REFERENCE NO. :
- 3129659
- LAST UPDATED :
- 199701
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C14-H24-O2
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- >5 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 26,409,1988
- 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
- REFERENCE :
- FCTOD7 Food and Chemical Toxicology. (Pergamon Press Inc., Maxwell House, Fairview Park, Elmsford, NY 10523) V.20- 1982- Volume(issue)/page/year: 26,409,1988
|
Safety Information
| Personal Protective Equipment | Eyeshields;Gloves |
|---|
| RIDADR | NONH for all modes of transport |
|---|
| WGK Germany | 2 |
|---|
| RTECS | UA2470450 |
|---|
Synonyms
| FEMA No. 3050 |
| EINECS 231-878-5 |
| Propanoic acid,2-methyl-,1-methyl-1-(4-methyl-3-cyclohexen-1-yl)ethyl ester |
| p-menth-1-en-8-yl-isobutyrate |
| 1-methyl-1-(4-methylcyclohex-3-enyl)ethyl isobutyrate |
| Terpinyl isobutyrate |
| Isobuttersaeure-p-menth-1-en-8-ylester |
| isobutyric acid p-menth-1-en-8-yl ester |
