3-(2-hydroxyethyl)-2-[3-[3-(2-hydroxyethyl)-3H-benzothiazol-2-ylidene]-2-methylprop-1-enyl]benzothiazolium bromide (CAS 52686-09-6) — formula C22H23N2O2S2.Br, molecular weight 491.5; category organic chemicals.
| CAS Number | 52686-09-6 |
|---|---|
| Molecular Formula | C22H23N2O2S2.Br |
| Molecular Weight | 491.5 |
| Applications | General Manufacturing Information: Benzothiazolium, 3-(2-hydroxyethyl)-2-[3-[3-(2-hydroxyethyl)-2(3H)-benzothiazolylidene]-2-methyl-1-propen-1-yl]-, bromide (1:1): INACTIVE |
| Category | Organic Chemicals |
Documented applications: General Manufacturing Information: Benzothiazolium, 3-(2-hydroxyethyl)-2-[3-[3-(2-hydroxyethyl)-2(3H)-benzothiazolylidene]-2-methyl-1-propen-1-yl]-, bromide (1:1): INACTIVE.
3-(2-hydroxyethyl)-2-[3-[3-(2-hydroxyethyl)-3H-benzothiazol-2-ylidene]-2-methylprop-1-enyl]benzothiazolium bromide is a carbon-based organic compound with CAS registry number 52686-09-6 and molecular formula C22H23N2O2S2.Br (molecular weight 491.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 52686-09-6
Its molecular formula C22H23N2O2S2.Br comprises 22 C, 23 H, 2 N, 2 O, 2 S, 1 Br atoms.
Also known as: 3-(2-hydroxyethyl)-2-[3-[3-(2-hydroxyethyl)-3H-benzothiazol-2-ylidene]-2-methylprop-1-enyl]benzothiazolium bromide · 3-(2-羟乙基)-2-[3-[3-(2-羟乙基)-3H-苯并噻唑-2-亚基]-2-甲基丙-1-烯基]苯并噻唑溴化物
Category: organic chemicals
The CAS registry number of 3-(2-hydroxyethyl)-2-[3-[3-(2-hydroxyethyl)-3H-benzothiazol-2-ylidene]-2-methylprop-1-enyl]benzothiazolium bromide is 52686-09-6.
Molecular formula C22H23N2O2S2.Br, molecular weight 491.5.
It is also registered under: 3-(2-hydroxyethyl)-2-[3-[3-(2-hydroxyethyl)-3H-benzothiazol-2-ylidene]-2-methylprop-1-enyl]benzothiazolium bromide, 3-(2-羟乙基)-2-[3-[3-(2-羟乙基)-3H-苯并噻唑-2-亚基]-2-甲基丙-1-烯基]苯并噻唑溴化物.
Recorded applications: General Manufacturing Information: Benzothiazolium, 3-(2-hydroxyethyl)-2-[3-[3-(2-hydroxyethyl)-2(3H)-benzothiazolylidene]-2-methyl-1-propen-1-yl]-, bromide (1:1): INACTIVE.
Category: Organic Chemicals.
Independent reference data for 3-(2-hydroxyethyl)-2-[3-[3-(2-hydroxyethyl)-3H-benzothiazol-2-ylidene]-2-methylprop-1-enyl]benzothiazolium bromide (CAS 52686-09-6), compiled from public chemistry databases.
| CAS 号 | 52686-09-6 |
|---|---|
| PubChem CID | 103671 |
| 分子式 | C22H23N2O2S2.Br |
| IUPAC 名称 | 2-[2-[3-[3-(2-hydroxyethyl)-1,3-benzothiazol-3-ium-2-yl]-2-methylprop-2-enylidene]-1,3-benzothiazol-3-yl]ethanol bromide |
| UNII（FDA） | NS00057678 |
| Molecular Weight | 491.5 |
|---|---|
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 6 |
| Exact Mass | 490.03843 |
| Monoisotopic Mass | 490.03843 |
| Topological Polar Surface Area | 101 |
| Heavy Atom Count | 29 |
DTXSID90886012; RefChem:566331; DTXCID201025362; 52686-09-6; HQUBHKNBGQLDPD-UHFFFAOYSA-M; EINECS 258-102-8; 3,3'-Bis(beta-hydroxyethyl)-9-methyl-2,2'-thiacarbocyanine bromide; DB-251773; NS00057678
3-(2-羟乙基)-2-[3-[3-(2-羟乙基)-3H-苯并噻唑-2-亚基]-2-甲基丙-1-烯基]苯并噻唑溴化物 · CAS 52686-09-6 · C22H23N2O2S2.Br. UNII NS00057678.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-(2-羟乙基)-2-[3-[3-(2-羟乙基)-3H-苯并噻唑-2-亚基]-2-甲基丙-1-烯基]苯并噻唑溴化物