2-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid (CAS 42780-40-5) — formula C16H19NO2, molecular weight 257.33; category organic chemicals.
| CAS Number | 42780-40-5 |
|---|---|
| Molecular Formula | C16H19NO2 |
| Molecular Weight | 257.33 |
| LogP | 3.3 |
| Category | Organic Chemicals |
2-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid is a carbon-based organic compound with CAS registry number 42780-40-5 and molecular formula C16H19NO2 (molecular weight 257.33), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 42780-40-5
Its molecular formula C16H19NO2 comprises 16 C, 19 H, 1 N, 2 O atoms.
Also known as: 2-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid · 2-[1-(2,4-二甲基苯基)-2,5-二甲基-吡咯-3-基]乙酸
Category: organic chemicals
The CAS registry number of 2-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid is 42780-40-5.
Molecular formula C16H19NO2, molecular weight 257.33.
It is also registered under: 2-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid, 2-[1-(2,4-二甲基苯基)-2,5-二甲基-吡咯-3-基]乙酸.
Category: Organic Chemicals.
Independent reference data for 2-[1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrol-3-yl]acetic acid (CAS 42780-40-5), compiled from public chemistry databases.
| CAS 号 | 42780-40-5 |
|---|---|
| PubChem CID | 206067 |
| 分子式 | C16H19NO2 |
| IUPAC 名称 | 2-[1-(2,4-dimethylphenyl)-2,5-dimethylpyrrol-3-yl]acetic acid |
| Molecular Weight | 257.33 |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 257.141578849 |
| Monoisotopic Mass | 257.141578849 |
| Topological Polar Surface Area | 42.2 |
| Heavy Atom Count | 19 |
42780-40-5; 1H-Pyrrole-3-acetic acid, 2,5-dimethyl-1-(2,4-dimethylphenyl)-; 2,5-Dimethyl-1-(2,4-dimethylphenyl)-1H-pyrrole-3-acetic acid; DTXSID80195463; RefChem:240573; DTXCID90117954; [1-(2,4-Dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]acetic acid
2-[1-(2,4-二甲基苯基)-2,5-二甲基-吡咯-3-基]乙酸 · CAS 42780-40-5 · C16H19NO2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.