1-(4-CHLOROPHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLIC ACID (CAS 60217-76-7) — formula C13H12ClNO2, molecular weight 249.69; category organic chemicals.
| CAS Number | 60217-76-7 |
|---|---|
| Molecular Formula | C13H12ClNO2 |
| Molecular Weight | 249.69 |
| LogP | 3.3 |
| Category | Organic Chemicals |
1-(4-CHLOROPHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLIC ACID is a carbon-based organic compound with CAS registry number 60217-76-7 and molecular formula C13H12ClNO2 (molecular weight 249.69), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 60217-76-7
Its molecular formula C13H12ClNO2 comprises 13 C, 12 H, 1 Cl, 1 N, 2 O atoms.
Also known as: 1-(4-CHLOROPHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLIC ACID · 1-(4-氯苯基)-2,5-二甲基吡咯-3-甲酸
Category: organic chemicals
The CAS registry number of 1-(4-CHLOROPHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLIC ACID is 60217-76-7.
Molecular formula C13H12ClNO2, molecular weight 249.69.
It is also registered under: 1-(4-CHLOROPHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLIC ACID, 1-(4-氯苯基)-2,5-二甲基吡咯-3-甲酸.
Category: Organic Chemicals.
Independent reference data for 1-(4-CHLOROPHENYL)-2,5-DIMETHYL-1H-PYRROLE-3-CARBOXYLIC ACID (CAS 60217-76-7), compiled from public chemistry databases.
| CAS 号 | 60217-76-7 |
|---|---|
| PubChem CID | 2739317 |
| 分子式 | C13H12ClNO2 |
| IUPAC 名称 | 1-(4-chlorophenyl)-2,5-dimethylpyrrole-3-carboxylic acid |
| Molecular Weight | 249.69 |
|---|---|
| XLogP3 | 3.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 249.0556563 |
| Monoisotopic Mass | 249.0556563 |
| Topological Polar Surface Area | 42.2 |
| Heavy Atom Count | 17 |
1-(4-Chlorophenyl)-2,5-dimethyl-1H-pyrrole-3-carboxylic acid; BRN 0405709; 1H-Pyrrole-3-carboxylic acid, 1-(4-chlorophenyl)-2,5-dimethyl-; DTXSID40208967; 5-22-01-00433 (Beilstein Handbook Reference); RefChem:224998; DTXCID90131458; 801-978-9; 60217-76-7; 1-(4-chlorophenyl)-2,5-dimethylpyrrole-3-carboxylic acid; MFCD00177046; CHEMBL4648146; Maybridge1_007508; Oprea1_324616; SCHEMBL1980763; HMS562N06
| 已通报的危害声明 | H315 (100%), H319 (100%), H335 (100%) |
|---|
1-(4-氯苯基)-2,5-二甲基吡咯-3-甲酸 · CAS 60217-76-7 · C13H12ClNO2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1-(4-氯苯基)-2,5-二甲基吡咯-3-甲酸