CAS Number18836-52-7
Synonymsmethyl 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; Pellitorin; Methyl trans,trans-sorbate; (2E,4E)-N-(2-methylpropyl)deca-2,4-dienamide; SORBIC ACID METHYL ESTER
Molecular FormulaC14H25NO
Molecular Weight223.354
Density0.9±0.1 g/cm3
Boiling Point368.7±15.0 °C at 760 mmHg
Melting Point88-89ºC
Appearancesolid
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 18836-52-7 |
| Catalog No. | 2A-1166733 |
| Chinese Name | 墙草碱 |
| 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; Pellitorin; Methyl trans,trans-sorbate; (2E,4E)-N-(2-methylpropyl)deca-2,4-dienamide; SORBIC ACID METHYL ESTER |
| Molecular Formula | C14H25NO |
| Molecular Weight | 223.354 |
| Density | 0.9±0.1 g/cm3 |
| Boiling Point | 368.7±15.0 °C at 760 mmHg |
| Melting Point | 88-89ºC |
| Appearance | solid |
| Storage Condition | 2-8℃, dry, sealed |
| Application | Pelitotine is a compound isolated from pepper roots. Pelitotine has strong cytotoxic activity against HL60 and MCT-7 cell lines. Pellitolin has potential in cancer disease research [1]. |
| HTC | 2924199090 |
| SMILES | CCCCCC=CC=CC(=O)NCC(C)C |
| InChI | InChI=1S/C14H25NO/c1-4-5-6-7-8-9-10-11-14(16)15-12-13(2)3/h8-11,13H,4-7,12H2,1-3H3,(H,15,16)/b9-8+,11-10+ |
| InChI Key | MAGQQZHFHJDIRE-BNFZFUHLSA-N |
| Use of | Properties Name (2E,4E)-N-Isobutyl-2,4-decadienamide Synonym More Synonyms Pellitorine Biological Activity Related Catalog Research Areas >> Cancer Signaling Pathways >> Others >> Others References Chemical & Physical Properties Molecular Formula C14H25NO Exact Mass 223.193619 PSA 29.10000 Index of Refraction 1.470 InChIKey MAGQQZHFHJDIRE-BNFZFUHLSA-N SMILES CCCCCC=CC=CC(=O)NCC(C)C Toxicological Information CHEMICAL IDENTIFICATION RTECS NUMBER : CHEMICAL NAME : 2,4-Decadienamide, N-isobutyl-, (E,E)- CAS REGISTRY NUMBER : 18836-52-7 BEILSTEIN REFERENCE NO. : LAST UPDATED : DATA ITEMS CITED : MOLECULAR FORMULA : C14-H25-N-O MOLECULAR WEIGHT : HEALTH HAZARD DATA ACUTE TOXICITY DATA TYPE OF TEST : TDLo - Lowest published toxic dose ROUTE OF EXPOSURE : 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 Safety Information Hazard Codes Xi HS Code 2924199090 Synthetic Route (Z)-2-octen-1-o... 26001-58-1 Pellitorine 18836-52-7 Literature: Bari; Sattar; Vig; Kumar; Vasisht Journal of the Indian Chemical Society, 1990 , vol. 67, # 12 p. 995 - 996 54542-97-1 Pellitorine 18836-52-7 Literature: Shakhmaev; Ishbaeva; Zorin Russian Journal of Organic Chemistry, 2012 , vol. 48, # 7 p. 908 - 913 35060-78-7 Pellitorine 18836-52-7 Literature: Sato, Toshio; Kawashima, Masatoshi; Fujisawa, Tamotsu Tetrahedron Letters, 1981 , vol. 22, # 25 p. 2375 - 2378 Precursor & DownStream Precursor 7 CAS#:639086-18-3 cis-pellitorine CAS#:30361-33-2 (2E,4E)-2,4-dec... CAS#:78-81-9 Isobutylamine CAS#:60595-37-1 (1E)-1-iodo-hep... DownStream 0 |
| Tax Rebate | 13.0% |
| Supervision | None. MFN tariff: 6.5%. Ordinary tariff: 30.0% |
| Transport Info | Product name: 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% |
| Related Products in Specialty Chemicals | ||
|---|---|---|
| isononyl anthranilate | 49553-64-2 | 2A-1166724 |
| Octyl-anthranilate | 55198-39-5 | 2A-1166725 |
| 4-PREGNEN-3,6,20-TRIONE | 2243-08-5 | 2A-1166728 |
| 2-(METHYLAMINO)-1-PROPANOL | 27646-78-2 | 2A-1166730 |
| Beef Thyroid Substance Powder/Liver extracts | 8002-47-9 | 2A-1166732 |
| ar-turmerone | 532-65-0 | 2A-1166734 |
| 12-DEOXYWITHASTRAMONOLIDE | 60124-17-6 | 2A-1166735 |
| BIS(4-HYDROXYCINNAMOYL)METHANE | 24939-16-0 | 2A-1166737 |
| CONESSINE | 546-06-5 | 2A-1166738 |
| (+)-[12S,13R]-EPOXY-CIS-9-OCTADECENOIC ACID METHYL ESTER | 2733-91-7 | 2A-1166739 |
| Browse all Specialty Chemicals products » | ||
Phone:
630-322-8886
630-322-8887
Email:
Office Locations:
Chicago, IL, USA
San Francisco, CA, USA
EN
SDS