Introduction：Basic information about CAS 104-27-8|1-Penten-3-one, 1- (4-methoxyphenyl)-, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 1-Penten-3-one, 1- (4-methoxyphenyl)- |
|---|
| CAS Number | 104-27-8 | Molecular Weight | 190.238 |
|---|
| Density | 1.0±0.1 g/cm3 | Boiling Point | 333.2±17.0 °C at 760 mmHg |
|---|
| Molecular Formula | C12H14O2 | Melting Point | / |
|---|
| MSDS | ChineseUSA | Flash Point | 151.5±14.5 °C |
|---|
Names
| Name | 1-(p-Methoxyphenyl)-1-penten-3-one |
|---|
| Synonym | More Synonyms |
|---|
Chemical & Physical Properties
| Density | 1.0±0.1 g/cm3 |
|---|
| Boiling Point | 333.2±17.0 °C at 760 mmHg |
|---|
| Molecular Formula | C12H14O2 |
|---|
| Molecular Weight | 190.238 |
|---|
| Flash Point | 151.5±14.5 °C |
|---|
| Exact Mass | 190.099380 |
|---|
| PSA | 26.30000 |
|---|
| LogP | 2.65 |
|---|
| Vapour Pressure | 0.0±0.7 mmHg at 25°C |
|---|
| Index of Refraction | 1.542 |
|---|
| InChIKey | SLDQOBRACOQXGE-QPJJXVBHSA-N |
|---|
| SMILES | CCC(=O)C=Cc1ccc(OC)cc1 |
|---|
Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- SB3927000
- CHEMICAL NAME :
- 1-Penten-3-one, 1-(p-methoxyphenyl)-
- CAS REGISTRY NUMBER :
- 104-27-8
- BEILSTEIN REFERENCE NO. :
- 3197137
- LAST UPDATED :
- 199709
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C12-H14-O2
- MOLECULAR WEIGHT :
- 190.26
- WISWESSER LINE NOTATION :
- Q1R C1U1V2
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- Standard Draize test
- ROUTE OF EXPOSURE :
- Administration onto the skin
- SPECIES OBSERVED :
- Rodent - rabbit
- REFERENCE :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 17,863,1979 ** ACUTE 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 :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 17,863,1979
- 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 :
- FCTXAV Food and Cosmetics Toxicology. (London, UK) V.1-19, 1963-81. For publisher information, see FCTOD7. Volume(issue)/page/year: 17,863,1979
|
Safety Information
| Hazard Codes | Xi |
|---|
| Risk Phrases | 43 |
|---|
| Safety Phrases | 36/37 |
|---|
| HS Code | 2914509090 |
|---|
Customs
| HS Code | 2914509090 |
|---|
| Summary | HS:2914509090 other ketones with other oxygen function VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0% |
|---|
Synonyms
| 1-Penten-3-one, 1- (p-methoxyphenyl)- |
| EINECS 203-190-5 |
| (1E)-1-(4-Methoxyphenyl)pent-1-en-3-one |
| 1-Penten-3-one, 1- (4-methoxyphenyl)- |
| 1-(4-Methoxyphenyl)-1-penten-3-one |
| (1E)-1-(4-Methoxyphenyl)-1-penten-3-one |
| 1-Penten-3-one, 1-(4-methoxyphenyl)-, (1E)- |
