5,6-Dimethyl-1H-benzotriazole hydrate (CAS 4184-79-6) — formula C8H9N3, molecular weight 147.18; category organic chemicals.
| CAS Number | 4184-79-6 |
|---|---|
| Molecular Formula | C8H9N3 |
| Molecular Weight | 147.18 |
| LogP | 1.8 |
| Category | Organic Chemicals |
5,6-Dimethyl-1H-benzotriazole hydrate is a carbon-based organic compound with CAS registry number 4184-79-6 and molecular formula C8H9N3 (molecular weight 147.18), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 4184-79-6
Its molecular formula C8H9N3 comprises 8 C, 9 H, 3 N atoms.
Also known as: 5,6-Dimethyl-1H-benzotriazole hydrate · 5,6-二甲基-1H-苯并三唑水合物
Category: organic chemicals
The CAS registry number of 5,6-Dimethyl-1H-benzotriazole hydrate is 4184-79-6.
Molecular formula C8H9N3, molecular weight 147.18.
It is also registered under: 5,6-Dimethyl-1H-benzotriazole hydrate, 5,6-二甲基-1H-苯并三唑水合物.
Category: Organic Chemicals.
Independent reference data for 5,6-Dimethyl-1H-benzotriazole hydrate (CAS 4184-79-6), compiled from public chemistry databases.
| CAS Registry Number | 4184-79-6 |
|---|---|
| PubChem CID | 77849 |
| Molecular formula | C8H9N3 |
| IUPAC name | 5,6-dimethyl-2H-benzotriazole |
| UNII (FDA) | NS00008674 |
| Molecular Weight | 147.18 |
|---|---|
| XLogP3 | 1.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 147.079647300 |
| Monoisotopic Mass | 147.079647300 |
| Topological Polar Surface Area | 41.6 |
| Heavy Atom Count | 11 |
| Collision Cross Section | 130.84 Ų [M-H]- |
|---|---|
| Collision Cross Section | 131.25 Ų [M+H]+ |
4184-79-6; 5,6-Dimethyl-1H-benzotriazole; 5,6-Dimethylbenzotriazole; EINECS 224-058-3; AI3-52170; 1H-Benzotriazole, 5,6-dimethyl-; DTXSID70881186; NSC 62005; RefChem:101201; DTXCID701022470; 224-058-3; MVPKIPGHRNIOPT-UHFFFAOYSA-N; 5,6-Dimethyl-1H-benzo[d][1,2,3]triazole; 5,6-Dimethyl-1H-1,2,3-benzotriazole; 5,6-DiMethyl-1,2,3-benzotriazole Hydrate; MFCD00005703
| Reported hazard statements | H315 (100%), H319 (100%), H335 (97.7%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
5,6-Dimethyl-1H-benzotriazole hydrate · CAS 4184-79-6 · C8H9N3. UNII NS00008674. Collision Cross Section: 130.84 Ų [M-H]-; Collision Cross Section: 131.25 Ų [M+H]+.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 5,6-二甲基-1H-苯并三唑水合物