1-(1,3-benzodioxol-5-ylmethyl)-4-[(2z,6e)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1,4-diazepane (CHEM344601)
| Record Information | |||||||||
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| Version | 1.0 | ||||||||
| Creation Date | 2026-08-31 12:50:02 UTC | ||||||||
| Update Date | 2026-08-31 12:50:02 UTC | ||||||||
| Accession Number | CHEM344601 | ||||||||
| Identification | |||||||||
| Common Name | 1-(1,3-benzodioxol-5-ylmethyl)-4-[(2z,6e)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1,4-diazepane | ||||||||
| Class | Small Molecule | ||||||||
| Description | 1-(1,3-benzodioxol-5-ylmethyl)-4-[(2z,6e)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1,4-diazepane is a chemical compound with the formula C28H42N2O2. It has an average molecular weight of 438.60 g/mol. | ||||||||
| Contaminant Sources | Not Available | ||||||||
| Contaminant Type | Not Available | ||||||||
| Chemical Structure |  | ||||||||
| Synonyms | Not Available | ||||||||
| Chemical Formula | C28H42N2O2 | ||||||||
| Average Molecular Mass | Not Available | ||||||||
| Monoisotopic Mass | 438.325 g/mol | ||||||||
| CAS Registry Number | 55500-19-1 | ||||||||
| IUPAC Name | 1-(1,3-benzodioxol-5-ylmethyl)-4-[(2z,6e)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1,4-diazepane | ||||||||
| Traditional Name | Not Available | ||||||||
| SMILES | CC(=CCCC(=CCCC(=CCN1CCCN(CC1)CC2=CC3=C(C=C2)OCO3)C)C)C | ||||||||
| InChI Identifier | InChI=1S/C28H42N2O2/c1-23(2)8-5-9-24(3)10-6-11-25(4)14-17-29-15-7-16-30(19-18-29)21-26-12-13-27-28(20-26)32-22-31-27/h8,10,12-14,20H,5-7,9,11,15-19,21-22H2,1-4H3/b24-10+,25-14- | ||||||||
| InChI Key | AEBAPUKTZYBOMY-ABMJGSPESA-N | ||||||||
| Chemical Taxonomy | |||||||||
| Classification | Not classified | ||||||||
| Biological Properties | |||||||||
| Status | Detected and Not Quantified | ||||||||
| Origin | Not Available | ||||||||
| Cellular Locations | Not Available | ||||||||
| Biofluid Locations | Not Available | ||||||||
| Tissue Locations | Not Available | ||||||||
| Pathways | Not Available | ||||||||
| Applications | Not Available | ||||||||
| Biological Roles | Not Available | ||||||||
| Chemical Roles | Not Available | ||||||||
| Physical Properties | |||||||||
| State | Not Available | ||||||||
| Appearance | Not Available | ||||||||
| Experimental Properties |
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| Predicted Properties | Not Available | ||||||||
| Spectra | |||||||||
| Spectra |
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| Toxicity Profile | |||||||||
| Route of Exposure | Not Available | ||||||||
| Mechanism of Toxicity | Not Available | ||||||||
| Metabolism | Not Available | ||||||||
| Toxicity Values | Not Available | ||||||||
| Lethal Dose | Not Available | ||||||||
| Carcinogenicity (IARC Classification) | Not Available | ||||||||
| Uses/Sources | Not Available | ||||||||
| Minimum Risk Level | Not Available | ||||||||
| Health Effects | Not Available | ||||||||
| Symptoms | Not Available | ||||||||
| Treatment | Not Available | ||||||||
| Concentrations | |||||||||
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| Identifiers | Not Available | ||||||||
| References | |||||||||
| Synthesis Reference | Not Available | ||||||||
| MSDS | Not Available | ||||||||
| General References | Not Available | ||||||||
