2-[(4,5-二氢-3-甲基-5-氧代-1-苯基-1H-吡唑-4-基)偶氮]苯甲酸(CAS 2898-84-2):分子式 C17H14N4O3、分子量 322.32。
| CAS号 | 2898-84-2 |
|---|---|
| 分子式 | C17H14N4O3 |
| 分子量 | 322.32 |
| LogP | 2.8 |
| 应用领域 | General Manufacturing Information: Benzoic acid、2-[2-(4、5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-: ACTIVE |
登记用途:General Manufacturing Information: Benzoic acid、2-[2-(4、5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-: ACTIVE。
2-[(4,5-二氢-3-甲基-5-氧代-1-苯基-1H-吡唑-4-基)偶氮]苯甲酸 是一种化工化合物,登记 CAS 号为 2898-84-2,分子式 C17H14N4O3(分子量 322.32)。
登记 CAS 号:2898-84-2
其分子式 C17H14N4O3 由 17 个碳、14 个氢、4 个氮、3 个氧 组成。
别名/同义词:2-[(4,5-二氢-3-甲基-5-氧代-1-苯基-1H-吡唑-4-基)偶氮]苯甲酸 · 2-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]benzoic acid
2-[(4,5-二氢-3-甲基-5-氧代-1-苯基-1H-吡唑-4-基)偶氮]苯甲酸 的 CAS 登记号为 2898-84-2。
分子式 C17H14N4O3,分子量 322.32。
别名/同义词:2-[(4,5-二氢-3-甲基-5-氧代-1-苯基-1H-吡唑-4-基)偶氮]苯甲酸、2-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]benzoic acid。
登记用途:General Manufacturing Information: Benzoic acid、2-[2-(4、5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-: ACTIVE。
2-[(4,5-二氢-3-甲基-5-氧代-1-苯基-1H-吡唑-4-基)偶氮]苯甲酸(CAS 2898-84-2)的独立参考数据,整理自公开化学数据库。
| CAS 号 | 2898-84-2 |
|---|---|
| PubChem CID | 102900 |
| 分子式 | C17H14N4O3 |
| IUPAC 名称 | 2-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzoic acid |
| UNII(FDA) | NS00048205 |
| Molecular Weight | 322.32 |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 4 |
| Exact Mass | 322.10659032 |
| Monoisotopic Mass | 322.10659032 |
| Topological Polar Surface Area | 94.7 |
| Heavy Atom Count | 24 |
Benzoic acid, 2-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-; 2-[(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]benzoic acid; DTXSID70883903; 2-((4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)benzoic acid; Benzoic acid, 2-(2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl)-; RefChem:448385; DTXCID701023385; 220-785-5; 2898-84-2; 2-[(1E)-2-(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)diazen-1-yl]benzoic acid; 2-(4,5-2H-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azobenzoic acid; 2-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]benzoic acid; 2-[(E)-(3-methyl-5-oxo-1-phenyl-4h-pyrazol-4-yl)azo]benzoic acid; 2-[(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)diazenyl]benzoic acid; 2-[(E)-(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)diazenyl]benzoic acid; Benzoic acid, 2-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-
| 已通报的危害声明 | H301 (27.3%), H400 (27.3%), H411 (72.7%) |
|---|
2-[(4,5-二氢-3-甲基-5-氧代-1-苯基-1H-吡唑-4-基)偶氮]苯甲酸 · CAS 2898-84-2 · C17H14N4O3. UNII NS00048205.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: 2-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]benzoic acid