5-甲酰基-2,4-二甲基-1H-吡咯-3-羧酸(CAS 253870-02-9):分子式 C8H9NO3、分子量 167.16。
| CAS号 | 253870-02-9 |
|---|---|
| 分子式 | C8H9NO3 |
| 分子量 | 167.16 |
| LogP | 0.8 |
5-甲酰基-2,4-二甲基-1H-吡咯-3-羧酸 是一种化工化合物,登记 CAS 号为 253870-02-9,分子式 C8H9NO3(分子量 167.16)。
登记 CAS 号:253870-02-9
其分子式 C8H9NO3 由 8 个碳、9 个氢、1 个氮、3 个氧 组成。
别名/同义词:5-甲酰基-2,4-二甲基-1H-吡咯-3-羧酸 · 5-Formyl-2,4-Dimethyl-1H-Pyrrole-3-Carboxylic Acid
5-甲酰基-2,4-二甲基-1H-吡咯-3-羧酸 的 CAS 登记号为 253870-02-9。
分子式 C8H9NO3,分子量 167.16。
别名/同义词:5-甲酰基-2,4-二甲基-1H-吡咯-3-羧酸、5-Formyl-2,4-Dimethyl-1H-Pyrrole-3-Carboxylic Acid。
5-甲酰基-2,4-二甲基-1H-吡咯-3-羧酸(CAS 253870-02-9)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 253870-02-9 |
|---|---|
| PubChem CID | 11073792 |
| Molecular formula | C8H9NO3 |
| IUPAC name | 5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic acid |
| Molecular Weight | 167.16 |
|---|---|
| XLogP3 | 0.8 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 167.058243149 |
| Monoisotopic Mass | 167.058243149 |
| Topological Polar Surface Area | 70.2 |
| Heavy Atom Count | 12 |
5-formyl-2,4-dimethyl-1H-pyrrole-3-carboxylic Acid; 253870-02-9; 1H-PYRROLE-3-CARBOXYLIC ACID, 5-FORMYL-2,4-DIMETHYL-; DTXSID10454191; RefChem:536029; DTXCID40405010; 607-716-8; 5-FORMYL-2,4-DIMETHYLPYRROLE-3-CARBOXYLIC ACID; MFCD06202342; 3,5-Dimethyl-2-formylpyrrole-4-carboxylic acid; Sunitinib Impurity 22; 3,5-dimethyl-2-formyl-1h-pyrrole-4-carboxylic acid; 5-Formyl-2,4-dimethyl-3-pyrrolecarboxylic Acid; 3Y-0054; 2,4-dimethyl-5-formylpyrrole-3-carboxylic acid; SCHEMBL394139
| GHS notification summary | 72.5% (29 / 40) |
|---|
| GHS notification summary | 72.5% (29 / 40) |
|---|---|
| Reported hazard statements | H302 (17.5%), H315 (25%), H319 (25%), H335 (22.5%) |
This chemical does not meet GHS hazard criteria for 72.5% (29 of 40) of all reports.
H302 (17.5%): Harmful if swallowed [Warning Acute toxicity, oral]
5-Formyl-2,4-Dimethyl-1H-Pyrrole-3-Carboxylic Acid · CAS 253870-02-9 · C8H9NO3.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: 5-Formyl-2,4-Dimethyl-1H-Pyrrole-3-Carboxylic Acid