Basic Blue 99 (CAS 68123-13-7) — formula C19H20BrClN4O2, molecular weight 450.05 g/mol; category pharmaceutical intermediates and APIs.
| CAS Number | 68123-13-7 |
|---|---|
| Molecular Formula | C19H20BrClN4O2 |
| Molecular Weight | 450.05 g/mol |
| Category | Pharmaceutical Raw Materials |
Basic Blue 99 is a pharmaceutical intermediate or API compound with CAS registry number 68123-13-7 and molecular formula C19H20BrClN4O2 (molecular weight 450.05 g/mol), belonging to the pharmaceutical intermediates and APIs segment of chemical raw materials.
CAS number: 68123-13-7
Its molecular formula C19H20BrClN4O2 comprises 19 C, 20 H, 1 Br, 1 Cl, 4 N, 2 O atoms.
Also known as: Basic Blue 99 · 碱性蓝99
Category: pharmaceutical intermediates and APIs
The CAS registry number of Basic Blue 99 is 68123-13-7.
Molecular formula C19H20BrClN4O2, molecular weight 450.05 g/mol.
It is also registered under: Basic Blue 99, 碱性蓝99.
Category: Pharmaceutical Raw Materials.
Independent reference data for Basic Blue 99 (CAS 68123-13-7), compiled from public chemistry databases.
| CAS 号 | 68123-13-7 |
|---|---|
| PubChem CID | 93377 |
| 分子式 | C19H20BrClN4O2 |
| 分子量 | 450.05 g/mol |
| IUPAC 名称 | [3-[(4,8-diamino-6-bromo-5-hydroxy-1-oxonaphthalen-2-ylidene)amino]phenyl]-trimethylazanium chloride |
| InChIKey | RFQSMLBZXQOMKK-UHFFFAOYSA-N |
| UNII（FDA） | P0U7VBC51E |
| Molecular Weight | 451.7 |
|---|---|
| Hydrogen Bond Donor Count | 3 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 2 |
| Exact Mass | 450.04582 |
| Monoisotopic Mass | 450.04582 |
| Topological Polar Surface Area | 102 |
| Heavy Atom Count | 27 |
Basic blue 99; 68123-13-7; C.I. Basic Blue 99; Jarocol Steel Blue; P0U7VBC51E; CI 56059; DTXSID60874042; ARIANOR STEEL BLUE 306004; RefChem:116616; DTXCID801012177; 268-544-3; [3-[(4,8-diamino-6-bromo-5-hydroxy-1-oxonaphthalen-2-ylidene)amino]phenyl]-trimethylazanium;chloride; BASICBLUE99; UNII-P0U7VBC51E; Arianor Steel Blue; EINECS 268-544-3
| 法规与食品接触 | CIR / INCI: Cosmetic ingredients (Basic Blue 99) -> CIR (Cosmetic Ingredient Review) CIR / INCI: Hair dyeing |
|---|---|
| GHS 通报统计 | 1.2% (1 / 83) |
| GHS 通报统计 | 1.2% (1 / 83) |
|---|---|
| 已通报的危害声明 | H318 (97.6%) |
碱性蓝99 的 CAS 号为 68123-13-7，分子式 C19H20BrClN4O2，分子量 450.05 g/mol。 UNII P0U7VBC51E; InChIKey RFQSMLBZXQOMKK-UHFFFAOYSA-N.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 碱性蓝99