2-CHLORO-5-PYRROL-1-YL-BENZOIC ACID (CAS 53242-68-5) — formula C11H8ClNO2, molecular weight 221.64; category organic chemicals.
| CAS Number | 53242-68-5 |
|---|---|
| Molecular Formula | C11H8ClNO2 |
| Molecular Weight | 221.64 |
| LogP | 2.6 |
| Category | Organic Chemicals |
2-CHLORO-5-PYRROL-1-YL-BENZOIC ACID is a carbon-based organic compound with CAS registry number 53242-68-5 and molecular formula C11H8ClNO2 (molecular weight 221.64), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 53242-68-5
Its molecular formula C11H8ClNO2 comprises 11 C, 8 H, 1 Cl, 1 N, 2 O atoms.
Also known as: 2-CHLORO-5-PYRROL-1-YL-BENZOIC ACID · 2-氯-5-(1H-吡咯-1-基)苯甲酸
Category: organic chemicals
The CAS registry number of 2-CHLORO-5-PYRROL-1-YL-BENZOIC ACID is 53242-68-5.
Molecular formula C11H8ClNO2, molecular weight 221.64.
It is also registered under: 2-CHLORO-5-PYRROL-1-YL-BENZOIC ACID, 2-氯-5-(1H-吡咯-1-基)苯甲酸.
Category: Organic Chemicals.
Independent reference data for 2-CHLORO-5-PYRROL-1-YL-BENZOIC ACID (CAS 53242-68-5), compiled from public chemistry databases.
| CAS 号 | 53242-68-5 |
|---|---|
| PubChem CID | 771122 |
| 分子式 | C11H8ClNO2 |
| IUPAC 名称 | 2-chloro-5-pyrrol-1-ylbenzoic acid |
| UNII（FDA） | ST50269762 |
| Molecular Weight | 221.64 |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 221.0243562 |
| Monoisotopic Mass | 221.0243562 |
| Topological Polar Surface Area | 42.2 |
| Heavy Atom Count | 15 |
53242-68-5; 2-chloro-5-(1H-pyrrol-1-yl)benzoic acid; RefChem:469167; 861-748-9; 2-Chloro-5-pyrrol-1-yl-benzoic acid; NB-64; 2-chloro-5-pyrrol-1-ylbenzoic acid; MFCD03036852; 2-chloro-5-pyrrolylbenzoic acid; Cambridge id 6500658; Benzoic acid, 2-chloro-5-(1H-pyrrol-1-yl)-; Oprea1_183081; Oprea1_826765; CHEMBL405828; orb1699868; SCHEMBL1785215
| 已通报的危害声明 | H315 (100%), H319 (100%), H335 (100%) |
|---|
2-氯-5-(1H-吡咯-1-基)苯甲酸 · CAS 53242-68-5 · C11H8ClNO2. UNII ST50269762.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 2-氯-5-(1H-吡咯-1-基)苯甲酸