| CAS Number | 1990538-03-8 |
| Catalog Number | AG01CBX7(AGN-PC-0WG7ZB) |
| Chemical Name | 4,9-diisobutyl-1,6-diazecane-2,7-dione |
| IUPAC Name | 4,9-bis(2-methylpropyl)-1,6-diazecane-2,7-dione |
| InChI | InChI=1S/C16H30N2O2/c1-11(2)5-13-7-15(19)18-10-14(6-12(3)4)8-16(20)17-9-13/h11-14H,5-10H2,1-4H3,(H,17,20)(H,18,19) |
| InChI Key | IABCYXCIMBXWBS-UHFFFAOYSA-N |
| Molecular Formula | C16H30N2O2 |
| Molecular Weight | 282.4216 |
| SMILES | O=C(CC(CC(C)C)CN1)NCC(CC(C)C)CC1=O |
| Synonyms | 4,9-Diisobutyl-1,6-diazecane-2,7-dione,
1990538-03-8,
|
| Complexity | 294 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 282.231g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 282.428g/mol |
| Monoisotopic Mass | 282.231g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 58.2A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number