Methylbenzotriazole (CAS 29878-31-7) — formula C7H7N3, molecular weight 133.15; category specialty chemicals.
Methylbenzotriazole is a specialty compound with CAS registry number 29878-31-7 and molecular formula C7H7N3 (molecular weight 133.15), belonging to the specialty chemicals segment of chemical raw materials.
CAS number: 29878-31-7
Its molecular formula C7H7N3 comprises 7 C, 7 H, 3 N atoms.
Also known as: Methylbenzotriazole · Tolyltriazole
Category: specialty chemicals
The CAS registry number of Methylbenzotriazole is 29878-31-7.
Molecular formula C7H7N3, molecular weight 133.15.
It is also registered under: Methylbenzotriazole, Tolyltriazole.
Category: Water Treatment Chemicals.
Public-database records for Methylbenzotriazole (CAS 29878-31-7), reproduced here for independent cross-checking.
| GHS notification summary | 46.8% (37 / 79) |
|---|---|
| Reported hazard statements | H302 (53.2%), H319 (51.9%), H332 (51.9%), H412 (51.9%) |
This chemical does not meet GHS hazard criteria for 46.8% (37 of 79) of reports.
H302 (53.2%): Harmful if swallowed [Warning Acute toxicity, oral]
| GHS notification summary | 46.8% (37 / 79) |
|---|
| Collision Cross Section | 126.79 Ų [M+H]+ |
|---|---|
| Collision Cross Section | 123.7 Ų [M-H]- |
| CAS Registry Number | 29878-31-7 |
|---|---|
| PubChem CID | 122499 |
| 分子式 | C7H7N3 |
| IUPAC 名称 | 4-methyl-2H-benzotriazole |
| UNII(FDA) | QKK8999IZA |
29878-31-7; 4-Methyl-1H-benzotriazole; 4-METHYLBENZOTRIAZOLE; 4-Tolyltriazole; 1H-Benzotriazole, 4-methyl-; 4-methyl-1,2,3-benzotriazole; QKK8999IZA; DTXSID50274037; 1H-BENZOTRIAZOLE, 7-METHYL-; RefChem:53342; 249-921-1; 4-Methyl-1H-benzo[d][1,2,3]triazole; 4-methyl-1H-1,2,3-benzotriazole; 4-methyl-2H-benzotriazole; Methylbenzotriazole; 7-Methyl-1H-benzotriazole
| 分子量 | 133.15 |
|---|---|
| XLogP3 | 1.4 |
| 氢键供体数 | 1 |
| 氢键受体数 | 2 |
| 可旋转键数 | 0 |
| 精确质量 | 133.063997236 |
| 单同位素质量 | 133.063997236 |
| 拓扑极性表面积 | 41.6 |
| 重原子数 | 10 |
| 形式电荷 | 0 |
Methylbenzotriazole · CAS 29878-31-7 · C7H7N3. UNII QKK8999IZA. Collision Cross Section: 126.79 Ų [M+H]+; Collision Cross Section: 123.7 Ų [M-H]-.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.