Introduction：Basic information about CAS 18836-52-7|Pellitorine, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Pellitorine |
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| CAS Number | 18836-52-7 | Molecular Weight | 223.354 |
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| Density | 0.9±0.1 g/cm3 | Boiling Point | 368.7±15.0 °C at 760 mmHg |
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| Molecular Formula | C14H25NO | Melting Point | 88-89ºC |
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| MSDS | / | Flash Point | 224.6±5.3 °C |
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Names
| Name | (2E,4E)-N-Isobutyl-2,4-decadienamide |
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| Synonym | More Synonyms |
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Pellitorine BiologicalActivity
| Description | Pellitorine is a compound isolated from the roots of Piper nigrum. Pellitorine shows strong cytotoxic activities against HL60 and MCT-7 cell lines. Pellitorine has the potential for the research of cancer diseases[1]. |
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| Related Catalog | Research Areas >>CancerSignaling Pathways >>Others >>Others |
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| References | [1]. Ee GC, et al. Pellitorine, a potential anti-cancer lead compound against HL6 and MCT-7 cell lines and microbial transformation of piperine from Piper Nigrum. Molecules. 2010;15(4):2398-2404. |
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Chemical & Physical Properties
| Density | 0.9±0.1 g/cm3 |
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| Boiling Point | 368.7±15.0 °C at 760 mmHg |
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| Melting Point | 88-89ºC |
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| Molecular Formula | C14H25NO |
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| Molecular Weight | 223.354 |
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| Flash Point | 224.6±5.3 °C |
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| Exact Mass | 223.193619 |
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| PSA | 29.10000 |
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| LogP | 3.92 |
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| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
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| Index of Refraction | 1.470 |
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| InChIKey | MAGQQZHFHJDIRE-BNFZFUHLSA-N |
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| SMILES | CCCCCC=CC=CC(=O)NCC(C)C |
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Toxicological Information
CHEMICAL IDENTIFICATION - RTECS NUMBER :
- HD3510500
- CHEMICAL NAME :
- 2,4-Decadienamide, N-isobutyl-, (E,E)-
- CAS REGISTRY NUMBER :
- 18836-52-7
- BEILSTEIN REFERENCE NO. :
- 1725967
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C14-H25-N-O
- MOLECULAR WEIGHT :
- 223.40
HEALTH HAZARD DATAACUTE TOXICITY DATA - TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- DOSE :
- 700 mg/kg
- SEX/DURATION :
- female 1-7 day(s) after conception
- TOXIC EFFECTS :
- Reproductive - Fertility - pre-implantation mortality (e.g. reduction in number of implants per female; total number of implants per corpora lutea)
- REFERENCE :
- IJSIDW Indian Journal of Pharmaceutical Sciences. (Kalina, Santa Cruz (East), Bombay 400 029, India) V.40(2)- 1978- Volume(issue)/page/year: 40,113,1978
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Safety Information
| Hazard Codes | Xi |
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| HS Code | 2924199090 |
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Customs
| HS Code | 2924199090 |
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| Summary | 2924199090. other acyclic amides (including acyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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Synonyms
| methyl trans |
| (2E,4E)-N-Isobutyl-2,4-decadienamide |
| trans-2,4-hexadienoate |
| (2E,4E)-N-Isobutyldeca-2,4-dienamide |
| pellitorine |
| METHYL T2 T4 HEXADIENOATE |
| E,E-N-Isobutyl-2,4-decadienamide |
| 2,4-Decadienamide, N-(2-methylpropyl)-, (2E,4E)- |
| Pellitorin |
| Methyl trans,trans-sorbate |
| (2E,4E)-N-(2-methylpropyl)deca-2,4-dienamide |
| SORBIC ACID METHYL ESTER |
