hexaethyl 2,2',2''-[(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris(6,1-hexanediyliminocarbonyl)]trismalonate (CAS 93919-07-4) — formula C45H66N6O18, molecular weight 979.0; category organic chemicals.
| CAS Number | 93919-07-4 |
|---|---|
| Molecular Formula | C45H66N6O18 |
| Molecular Weight | 979.0 |
| LogP | 4.6 |
| Category | Organic Chemicals |
hexaethyl 2,2',2''-[(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris(6,1-hexanediyliminocarbonyl)]trismalonate is a carbon-based organic compound with CAS registry number 93919-07-4 and molecular formula C45H66N6O18 (molecular weight 979.0), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 93919-07-4
Its molecular formula C45H66N6O18 comprises 45 C, 66 H, 6 N, 18 O atoms.
Also known as: hexaethyl 2,2',2''-[(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris(6,1-hexanediyliminocarbonyl)]trismalonate · 2,2',2''-[(2,4,6-三氧代-1,3,5-三嗪-1,3,5(2H,4H,6H)-三基)三(6,1-己二基亚氨基羰基)]三丙二酸六乙酯
Category: organic chemicals
The CAS registry number of hexaethyl 2,2',2''-[(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris(6,1-hexanediyliminocarbonyl)]trismalonate is 93919-07-4.
Molecular formula C45H66N6O18, molecular weight 979.0.
It is also registered under: hexaethyl 2,2',2''-[(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris(6,1-hexanediyliminocarbonyl)]trismalonate, 2,2',2''-[(2,4,6-三氧代-1,3,5-三嗪-1,3,5(2H,4H,6H)-三基)三(6,1-己二基亚氨基羰基)]三丙二酸六乙酯.
Category: Organic Chemicals.
Independent reference data for hexaethyl 2,2',2''-[(2,4,6-trioxo-1,3,5-triazine-1,3,5(2H,4H,6H)-triyl)tris(6,1-hexanediyliminocarbonyl)]trismalonate (CAS 93919-07-4), compiled from public chemistry databases.
| CAS 号 | 93919-07-4 |
|---|---|
| PubChem CID | 44151733 |
| 分子式 | C45H66N6O18 |
| IUPAC 名称 | diethyl 2-[2-[3,5-bis[1-(3-ethoxy-2-ethoxycarbonyl-3-oxopropanoyl)azepan-2-yl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]azepane-1-carbonyl]propanedioate |
| Molecular Weight | 979.0 |
|---|---|
| XLogP3 | 4.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 18 |
| Rotatable Bond Count | 24 |
| Exact Mass | 978.44335928 |
| Monoisotopic Mass | 978.44335928 |
| Topological Polar Surface Area | 280 |
| Heavy Atom Count | 69 |
RefChem:786070; 299-990-7; EINECS 299-990-7
| GHS 通报统计 | 100% (104 / 104) |
|---|
| GHS 通报统计 | 100% (104 / 104) |
|---|
2,2',2''-[(2,4,6-三氧代-1,3,5-三嗪-1,3,5(2H,4H,6H)-三基)三(6,1-己二基亚氨基羰基)]三丙二酸六乙酯 · CAS 93919-07-4 · C45H66N6O18.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2,2',2''-[(2,4,6-三氧代-1,3,5-三嗪-1,3,5(2H,4H,6H)-三基)三(6,1-己二基亚氨基羰基)]三丙二酸六乙酯