≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Description
Accelerator for polymerization reactions.
| Canonical Smiles | CCCCN(CCCC)C1CCCCN2C1=NCCC2 |
|---|---|
| IUPAC Name | N,N-dibutyl-2,3,4,6,7,8,9,10-octahydropyrimido[1,2-a]azepin-10-amine |
| InChIKey | MGKYTFDYDXZTEM-UHFFFAOYSA-N |
| INCHI | 1S/C17H33N3/c1-3-5-12-19(13-6-4-2)16-10-7-8-14-20-15-9-11-18-17(16)20/h16H,3-15H2,1-2H3 |
| Isomeric SMILES | CCCCN(CCCC)C1CCCCN2C1=NCCC2 |
| UN Number | 1760 |
| Molecular Weight | 279.46 |
| Reaxy-Rn | 14261619 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14261619&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Azepanes |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Azepanes |
| Alternative Parents | Imidolactams Hydropyrimidines Trialkylamines Propargyl-type 1,3-dipolar organic compounds Carboximidamides Carboxamidines Azacyclic compounds Hydrocarbon derivatives |
| Molecular Framework | Aliphatic heteropolycyclic compounds |
| Substituents | Azepane - Hydropyrimidine - 1,4,5,6-tetrahydropyrimidine - Imidolactam - Tertiary amine - Tertiary aliphatic amine - Amidine - Carboxylic acid amidine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Amine - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Aliphatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as azepanes. These are organic compounds containing a saturated seven member heterocycle, with one nitrogen atom. |
| External Descriptors | Not available |
| Solubility | H2O: insoluble; organic solvents: soluble |
|---|---|
| Refractive Index | n20/D 1.5 (lit.) |
| Flash Point(°F) | 230.0 °F - closed cup |
| Flash Point(°C) | 110 °C - closed cup |
| Boil Point(°C) | 312℃ (lit.) |
| Molecular Weight | 279.500 g/mol |
| XLogP3 | 3.200 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 7 |
| Exact Mass | 279.267 Da |
| Monoisotopic Mass | 279.267 Da |
| Topological Polar Surface Area | 18.800 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 293.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
![6-(Dibutylamino)-1,8-diazabicyclo[5.4.0]undec-7-ene - ≥98% CAS No(106847-76-1) by Aladdin Scientific](https://www.aladdinsci.com/media/catalog/product/cache/207e23213cf636ccdef205098cf3c8a3/D/4/D472198.png)