2-[2-[4-[(2-cyanoethyl)ethylamino]-o-tolyl]vinyl]-1,3,3-trimethyl-3H-indolium dihydrogen phosphate (CAS 72208-20-9) — formula C25H30N3.H2O4P, molecular weight 469.5; category organic chemicals.
| CAS Number | 72208-20-9 |
|---|---|
| Molecular Formula | C25H30N3.H2O4P |
| Molecular Weight | 469.5 |
| Applications | General Manufacturing Information: 3H-Indolium, 2-[2-[4-[(2-cyanoethyl)ethylamino]-2-methylphenyl]ethenyl]-1, 3, 3-trimethyl-, phosphate (1:1): ACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: 3H-Indolium, 2-[2-[4-[(2-cyanoethyl)ethylamino]-2-methylphenyl]ethenyl]-1, 3, 3-trimethyl-, phosphate (1:1): ACTIVE.
2-[2-[4-[(2-cyanoethyl)ethylamino]-o-tolyl]vinyl]-1,3,3-trimethyl-3H-indolium dihydrogen phosphate is a carbon-based organic compound with CAS registry number 72208-20-9 and molecular formula C25H30N3.H2O4P (molecular weight 469.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 72208-20-9
Its molecular formula C25H30N3.H2O4P comprises 25 C, 32 H, 3 N, 4 O, 1 P atoms.
Also known as: 2-[2-[4-[(2-cyanoethyl)ethylamino]-o-tolyl]vinyl]-1,3,3-trimethyl-3H-indolium dihydrogen phosphate · 2-[2-[4-[(2-氰乙基)乙氨基]-2-甲基苯基]乙烯基]-1,3,3-三甲基-3H-吲哚磷酸盐
Category: organic chemicals
The CAS registry number of 2-[2-[4-[(2-cyanoethyl)ethylamino]-o-tolyl]vinyl]-1,3,3-trimethyl-3H-indolium dihydrogen phosphate is 72208-20-9.
Molecular formula C25H30N3.H2O4P, molecular weight 469.5.
It is also registered under: 2-[2-[4-[(2-cyanoethyl)ethylamino]-o-tolyl]vinyl]-1,3,3-trimethyl-3H-indolium dihydrogen phosphate, 2-[2-[4-[(2-氰乙基)乙氨基]-2-甲基苯基]乙烯基]-1,3,3-三甲基-3H-吲哚磷酸盐.
Recorded applications: General Manufacturing Information: 3H-Indolium, 2-[2-[4-[(2-cyanoethyl)ethylamino]-2-methylphenyl]ethenyl]-1, 3, 3-trimethyl-, phosphate (1:1): ACTIVE.
Category: Organic Chemicals.
Independent reference data for 2-[2-[4-[(2-cyanoethyl)ethylamino]-o-tolyl]vinyl]-1,3,3-trimethyl-3H-indolium dihydrogen phosphate (CAS 72208-20-9), compiled from public chemistry databases.
| CAS 号 | 72208-20-9 |
|---|---|
| PubChem CID | 44145482 |
| 分子式 | C25H30N3.H2O4P |
| IUPAC 名称 | dihydrogen phosphate;3-[N-ethyl-3-methyl-4-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]anilino]propanenitrile |
| Molecular Weight | 469.5 |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 469.21304351 |
| Monoisotopic Mass | 469.21304351 |
| Topological Polar Surface Area | 111 |
| Heavy Atom Count | 33 |
72208-20-9; EINECS 276-470-8; DTXSID3072533; 2-(4-((2-Cyanoethyl)ethylamino)-2-methylstyryl)-1,3,3-trimethyl-3H-indolium dihydrogen phosphate; 3H-Indolium, 2-(2-(4-((2-cyanoethyl)ethylamino)-2-methylphenyl)ethenyl)-1,3,3-trimethyl-, phosphate (1:1); 2-(4-((2-Cyanoethyl)ethylamino)-2-methylstyryl)-1,3,3-trimethyl-3H-indolium, dihydrogen phosphate; 3H-Indolium, 2-[2-[4-[(2-cyanoethyl)ethylamino]-2-methylphenyl]ethenyl]-1,3,3-trimethyl-, phosphate (1:1); RefChem:95784; DTXCID3047261; 3H-Indolium, 2-[2-[4-[(2-cyanoethyl)ethylamino]-2-methylphenyl]ethenyl]-1,3,3-trimethyl-, phosphate; 2-(2-(4-((2-Cyanoethyl)ethylamino)-o-tolyl)vinyl)-1,3,3-trimethyl-3H-indolium dihydrogen phosphate
| GHS 通报统计 | 10% (1 / 10) |
|---|
| GHS 通报统计 | 10% (1 / 10) |
|---|---|
| 已通报的危害声明 | H302 (20%), H314 (20%), H318 (90%), H411 (20%), H412 (70%) |
2-[2-[4-[(2-氰乙基)乙氨基]-2-甲基苯基]乙烯基]-1,3,3-三甲基-3H-吲哚磷酸盐 · CAS 72208-20-9 · C25H30N3.H2O4P.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.