3-(3-amino-3-oxopropyl)-2-[[4-(diethylamino)-m-tolyl]azo]-6-methylbenzothiazolium chloride (CAS 12221-39-5) — formula C22H28ClN5OS, molecular weight 446.0; category organic chemicals.
| CAS Number | 12221-39-5 |
|---|---|
| Molecular Formula | C22H28ClN5OS |
| Molecular Weight | 446.0 |
| Category | Organic Chemicals |
3-(3-amino-3-oxopropyl)-2-[[4-(diethylamino)-m-tolyl]azo]-6-methylbenzothiazolium chloride is a carbon-based organic compound with CAS registry number 12221-39-5 and molecular formula C22H28ClN5OS (molecular weight 446.0), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 12221-39-5
Its molecular formula C22H28ClN5OS comprises 22 C, 28 H, 1 Cl, 5 N, 1 O, 1 S atoms.
Also known as: 3-(3-amino-3-oxopropyl)-2-[[4-(diethylamino)-m-tolyl]azo]-6-methylbenzothiazolium chloride · 3-(3-氨基-3-氧代丙基)-2-[[4-(二乙氨基)-间甲苯基]偶氮]-6-甲基苯并噻唑氯化物
Category: organic chemicals
The CAS registry number of 3-(3-amino-3-oxopropyl)-2-[[4-(diethylamino)-m-tolyl]azo]-6-methylbenzothiazolium chloride is 12221-39-5.
Molecular formula C22H28ClN5OS, molecular weight 446.0.
It is also registered under: 3-(3-amino-3-oxopropyl)-2-[[4-(diethylamino)-m-tolyl]azo]-6-methylbenzothiazolium chloride, 3-(3-氨基-3-氧代丙基)-2-[[4-(二乙氨基)-间甲苯基]偶氮]-6-甲基苯并噻唑氯化物.
Category: Organic Chemicals.
Independent reference data for 3-(3-amino-3-oxopropyl)-2-[[4-(diethylamino)-m-tolyl]azo]-6-methylbenzothiazolium chloride (CAS 12221-39-5), compiled from public chemistry databases.
| CAS 号 | 12221-39-5 |
|---|---|
| PubChem CID | 23355477 |
| 分子式 | C22H28ClN5OS |
| IUPAC 名称 | 3-[2-[[4-(diethylamino)-3-methylphenyl]diazenyl]-6-methyl-1,3-benzothiazol-3-ium-3-yl]propanamide chloride |
| UNII（FDA） | NS00052565 |
| Molecular Weight | 446.0 |
|---|---|
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 8 |
| Exact Mass | 445.1703094 |
| Monoisotopic Mass | 445.1703094 |
| Topological Polar Surface Area | 103 |
| Heavy Atom Count | 30 |
12221-39-5; EINECS 235-412-1; 3-(3-Amino-3-oxopropyl)-2-((4-(diethylamino)-m-tolyl)azo)-6-methylbenzothiazolium chloride; 3-(3-amino-3-oxopropyl)-2-[[4-(diethylamino)-m-tolyl]azo]-6-methylbenzothiazolium chloride; RefChem:274077; 235-412-1; 3-[2-[[4-(diethylamino)-3-methylphenyl]diazenyl]-6-methyl-1,3-benzothiazol-3-ium-3-yl]propanamide;chloride; NS00052565; 3-[2-[[4-(diethylamino)-3-methylphenyl]diazenyl]-6-methyl-1,3-benzothiazol-3-ium-3-yl]propanamide
3-(3-氨基-3-氧代丙基)-2-[[4-(二乙氨基)-间甲苯基]偶氮]-6-甲基苯并噻唑氯化物 · CAS 12221-39-5 · C22H28ClN5OS. UNII NS00052565.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.