(all-Z)-2-(heptadeca-8,11-dienyl)-4,5-dihydro-1-methyl-1-[2-[(octadeca-9,12-dienoyl)amino]ethyl]-1H-imidazolium methyl sulphate (CAS 93858-36-7) — formula C42H77N3O5S, molecular weight 736.1; category organic chemicals.
| CAS Number | 93858-36-7 |
|---|---|
| Molecular Formula | C42H77N3O5S |
| Molecular Weight | 736.1 |
| Category | Organic Chemicals |
(all-Z)-2-(heptadeca-8,11-dienyl)-4,5-dihydro-1-methyl-1-[2-[(octadeca-9,12-dienoyl)amino]ethyl]-1H-imidazolium methyl sulphate is a carbon-based organic compound with CAS registry number 93858-36-7 and molecular formula C42H77N3O5S (molecular weight 736.1), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 93858-36-7
Its molecular formula C42H77N3O5S comprises 42 C, 77 H, 3 N, 5 O, 1 S atoms.
Also known as: (all-Z)-2-(heptadeca-8,11-dienyl)-4,5-dihydro-1-methyl-1-[2-[(octadeca-9,12-dienoyl)amino]ethyl]-1H-imidazolium methyl sulphate · (全-Z)-2-(十七-8,11-二烯基)-4,5-二氢-1-甲基-1-[2-[(十八-9,12-二烯酰基)氨基]乙基]-1H-咪唑鎓甲基硫酸盐
Category: organic chemicals
The CAS registry number of (all-Z)-2-(heptadeca-8,11-dienyl)-4,5-dihydro-1-methyl-1-[2-[(octadeca-9,12-dienoyl)amino]ethyl]-1H-imidazolium methyl sulphate is 93858-36-7.
Molecular formula C42H77N3O5S, molecular weight 736.1.
It is also registered under: (all-Z)-2-(heptadeca-8,11-dienyl)-4,5-dihydro-1-methyl-1-[2-[(octadeca-9,12-dienoyl)amino]ethyl]-1H-imidazolium methyl sulphate, (全-Z)-2-(十七-8,11-二烯基)-4,5-二氢-1-甲基-1-[2-[(十八-9,12-二烯酰基)氨基]乙基]-1H-咪唑鎓甲基硫酸盐.
Category: Organic Chemicals.
Independent reference data for (all-Z)-2-(heptadeca-8,11-dienyl)-4,5-dihydro-1-methyl-1-[2-[(octadeca-9,12-dienoyl)amino]ethyl]-1H-imidazolium methyl sulphate (CAS 93858-36-7), compiled from public chemistry databases.
| CAS 号 | 93858-36-7 |
|---|---|
| PubChem CID | 44148336 |
| 分子式 | C42H77N3O5S |
| IUPAC 名称 | (9Z,12Z)-N-[2-[2-[(8Z,11Z)-heptadeca-8,11-dienyl]-1-methyl-4,5-dihydroimidazol-1-ium-1-yl]ethyl]octadeca-9,12-dienamide;methyl sulfate |
| UNII（FDA） | 552IHG9TUN |
| Molecular Weight | 736.1 |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 31 |
| Exact Mass | 735.55839374 |
| Monoisotopic Mass | 735.55839374 |
| Topological Polar Surface Area | 116 |
| Heavy Atom Count | 51 |
93858-36-7; EINECS 299-268-1; 552IHG9TUN; Q27261264
(全-Z)-2-(十七-8,11-二烯基)-4,5-二氢-1-甲基-1-[2-[(十八-9,12-二烯酰基)氨基]乙基]-1H-咪唑鎓甲基硫酸盐 · CAS 93858-36-7 · C42H77N3O5S. UNII 552IHG9TUN.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: (全-Z)-2-(十七-8,11-二烯基)-4,5-二氢-1-甲基-1-[2-[(十八-9,12-二烯酰基)氨基]乙基]-1H-咪唑鎓甲基硫酸盐