2-[2-[4-[(2-chloroethyl)methylamino]phenyl]vinyl]-1,3,3-trimethyl-3H-indolium methyl sulphate (CAS 85204-55-3) — formula C23H29ClN2O4S, molecular weight 465.0; category organic chemicals.
| CAS Number | 85204-55-3 |
|---|---|
| Molecular Formula | C23H29ClN2O4S |
| Molecular Weight | 465.0 |
| Category | Organic Chemicals |
2-[2-[4-[(2-chloroethyl)methylamino]phenyl]vinyl]-1,3,3-trimethyl-3H-indolium methyl sulphate is a carbon-based organic compound with CAS registry number 85204-55-3 and molecular formula C23H29ClN2O4S (molecular weight 465.0), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 85204-55-3
Its molecular formula C23H29ClN2O4S comprises 23 C, 29 H, 1 Cl, 2 N, 4 O, 1 S atoms.
Also known as: 2-[2-[4-[(2-chloroethyl)methylamino]phenyl]vinyl]-1,3,3-trimethyl-3H-indolium methyl sulphate · 2-[2-[4-[(2-氯乙基)甲氨基]苯基]乙烯基]-1,3,3-三甲基-3H-吲哚甲酯硫酸盐
Category: organic chemicals
The CAS registry number of 2-[2-[4-[(2-chloroethyl)methylamino]phenyl]vinyl]-1,3,3-trimethyl-3H-indolium methyl sulphate is 85204-55-3.
Molecular formula C23H29ClN2O4S, molecular weight 465.0.
It is also registered under: 2-[2-[4-[(2-chloroethyl)methylamino]phenyl]vinyl]-1,3,3-trimethyl-3H-indolium methyl sulphate, 2-[2-[4-[(2-氯乙基)甲氨基]苯基]乙烯基]-1,3,3-三甲基-3H-吲哚甲酯硫酸盐.
Category: Organic Chemicals.
Independent reference data for 2-[2-[4-[(2-chloroethyl)methylamino]phenyl]vinyl]-1,3,3-trimethyl-3H-indolium methyl sulphate (CAS 85204-55-3), compiled from public chemistry databases.
| CAS 号 | 85204-55-3 |
|---|---|
| PubChem CID | 44146775 |
| 分子式 | C23H29ClN2O4S |
| IUPAC 名称 | N-(2-chloroethyl)-N-methyl-4-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]aniline;methyl sulfate |
| UNII（FDA） | TZQ3AB6KGC |
| Molecular Weight | 465.0 |
|---|---|
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 464.1536563 |
| Monoisotopic Mass | 464.1536563 |
| Topological Polar Surface Area | 81.1 |
| Heavy Atom Count | 31 |
85204-55-3; EINECS 286-342-3; 2-(2-(4-((2-Chloroethyl)methylamino)phenyl)vinyl)-1,3,3-trimethyl-3H-indolium methyl sulphate; TZQ3AB6KGC; NS00093210; 2-(2-(4-((2-Chloroethyl)methylamino)phenyl)vinyl)-1,3,3-trimethyl-3H-indolium methyl sulfate; 3H-Indolium, 2-[2-[4-[(2-chloroethyl)methylamino]phenyl]ethenyl]-1,3,3-trimethyl-, methyl sulfate; 3H-Indolium, 2-[2-[4-[(2-chloroethyl)methylamino]phenyl]ethenyl]-1,3,3-trimethyl-, methyl sulfate (1:1)
2-[2-[4-[(2-氯乙基)甲氨基]苯基]乙烯基]-1,3,3-三甲基-3H-吲哚甲酯硫酸盐 · CAS 85204-55-3 · C23H29ClN2O4S. UNII TZQ3AB6KGC.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.