5-CHLORO-2-[(5-CHLORO-3-(4-SULFOBUTYL)-2(3H)-BENZOTHIAZOLYLIDENE)-2- METHYL- 1-PROPENYL]-3-(4-SULFOBUTYL)- BENZOTHIAZOLIUM HYDROXIDE, INNER SALT, SODIUM SALT (CAS 30457-67-1) — formula C26H28Cl2N2O6S4, molecular weight 663.7; category organic chemicals.
| CAS Number | 30457-67-1 |
|---|---|
| Molecular Formula | C26H28Cl2N2O6S4 |
| Molecular Weight | 663.7 |
| LogP | 6.6 |
| Category | Organic Chemicals |
5-CHLORO-2-[(5-CHLORO-3-(4-SULFOBUTYL)-2(3H)-BENZOTHIAZOLYLIDENE)-2- METHYL- 1-PROPENYL]-3-(4-SULFOBUTYL)- BENZOTHIAZOLIUM HYDROXIDE, INNER SALT, SODIUM SALT is a carbon-based organic compound with CAS registry number 30457-67-1 and molecular formula C26H28Cl2N2O6S4 (molecular weight 663.7), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 30457-67-1
Its molecular formula C26H28Cl2N2O6S4 comprises 26 C, 28 H, 2 Cl, 2 N, 6 O, 4 S atoms.
Also known as: 5-CHLORO-2-[(5-CHLORO-3-(4-SULFOBUTYL)-2(3H)-BENZOTHIAZOLYLIDENE)-2- METHYL- 1-PROPENYL]-3-(4-SULFOBUTYL)- BENZOTHIAZOLIUM HYDROXIDE, INNER SALT, SODIUM SALT · 5-氯-2-[(5-氯-3-(4-磺丁基)-2(3H)-亚苯并噻唑)-2-甲基-1-丙烯基]-3-(4-磺丁基)-苯并噻唑氢氧化物，内盐，钠盐
Category: organic chemicals
The CAS registry number of 5-CHLORO-2-[(5-CHLORO-3-(4-SULFOBUTYL)-2(3H)-BENZOTHIAZOLYLIDENE)-2- METHYL- 1-PROPENYL]-3-(4-SULFOBUTYL)- BENZOTHIAZOLIUM HYDROXIDE, INNER SALT, SODIUM SALT is 30457-67-1.
Molecular formula C26H28Cl2N2O6S4, molecular weight 663.7.
It is also registered under: 5-CHLORO-2-[(5-CHLORO-3-(4-SULFOBUTYL)-2(3H)-BENZOTHIAZOLYLIDENE)-2- METHYL- 1-PROPENYL]-3-(4-SULFOBUTYL)- BENZOTHIAZOLIUM HYDROXIDE, INNER SALT, SODIUM SALT, 5-氯-2-[(5-氯-3-(4-磺丁基)-2(3H)-亚苯并噻唑)-2-甲基-1-丙烯基]-3-(4-磺丁基)-苯并噻唑氢氧化物，内盐，钠盐.
Category: Organic Chemicals.
Independent reference data for 5-CHLORO-2-[(5-CHLORO-3-(4-SULFOBUTYL)-2(3H)-BENZOTHIAZOLYLIDENE)-2- METHYL- 1-PROPENYL]-3-(4-SULFOBUTYL)- BENZOTHIAZOLIUM HYDROXIDE, INNER SALT, SODIUM SALT (CAS 30457-67-1), compiled from public chemistry databases.
| CAS 号 | 30457-67-1 |
|---|---|
| PubChem CID | 169162 |
| 分子式 | C26H28Cl2N2O6S4 |
| IUPAC 名称 | 4-[5-chloro-2-[3-[5-chloro-3-(4-sulfobutyl)-1,3-benzothiazol-3-ium-2-yl]-2-methylprop-2-enylidene]-1,3-benzothiazol-3-yl]butane-1-sulfonate |
| UNII（FDA） | NS00127100 |
| Molecular Weight | 663.7 |
|---|---|
| XLogP3 | 6.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 9 |
| Rotatable Bond Count | 11 |
| Exact Mass | 662.0207267 |
| Monoisotopic Mass | 662.0207267 |
| Topological Polar Surface Area | 189 |
| Heavy Atom Count | 40 |
30457-67-1; DTXSID4067561; EINECS 250-209-8; RefChem:118671; DTXCID5038202; YZCQPIXUPCHLBO-UHFFFAOYSA-N; NS00127100
5-氯-2-[(5-氯-3-(4-磺丁基)-2(3H)-亚苯并噻唑)-2-甲基-1-丙烯基]-3-(4-磺丁基)-苯并噻唑氢氧化物，内盐，钠盐 · CAS 30457-67-1 · C26H28Cl2N2O6S4. UNII NS00127100.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5-氯-2-[(5-氯-3-(4-磺丁基)-2(3H)-亚苯并噻唑)-2-甲基-1-丙烯基]-3-(4-磺丁基)-苯并噻唑氢氧化物，内盐，钠盐