2-Chloro-4-methylsulfonylbenzoic acid (CAS 53250-83-2) — formula C8H7ClO4S, molecular weight 234.66; category organic chemicals.
Documented applications: Use Classification: Environmental transformation -> Pesticide transformation products (metabolite, successor).
2-Chloro-4-methylsulfonylbenzoic acid is a carbon-based organic compound with CAS registry number 53250-83-2 and molecular formula C8H7ClO4S (molecular weight 234.66), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 53250-83-2
Its molecular formula C8H7ClO4S comprises 8 C, 7 H, 1 Cl, 4 O, 1 S atoms.
Also known as: 2-Chloro-4-methylsulfonylbenzoic acid · 2-氯-4-甲磺酰基苯甲酸
Category: organic chemicals
The CAS registry number of 2-Chloro-4-methylsulfonylbenzoic acid is 53250-83-2.
Molecular formula C8H7ClO4S, molecular weight 234.66.
It is also registered under: 2-Chloro-4-methylsulfonylbenzoic acid, 2-氯-4-甲磺酰基苯甲酸.
Recorded applications: Use Classification: Environmental transformation -> Pesticide transformation products (metabolite, successor).
Category: Organic Chemicals.
Public-database records for 2-Chloro-4-methylsulfonylbenzoic acid (CAS 53250-83-2), reproduced here for independent cross-checking.
| Reported hazard statements | H318, H302 (25%), H312 (12.5%), H315 (50%), H319 (37.5%), H332 (12.5%), H335 (50%) |
|---|
H318: Causes serious eye damage [Danger Serious eye damage/eye irritation]
P264+P265, P280, P305+P354+P338, and P317 (click each P-code to see the statement)
| CAS Registry Number | 53250-83-2 |
|---|---|
| PubChem CID | 735863 |
| 分子式 | C8H7ClO4S |
| IUPAC 名称 | 2-chloro-4-methylsulfonylbenzoic acid |
| UNII（FDA） | PM45Q33ZR6 |
2-Chloro-4-(methylsulfonyl)benzoic acid; Benzoic acid, 2-chloro-4-(methylsulfonyl)-; DTXSID10201364; EC 406-520-8; RefChem:86228; DTXCID10123855; 406-520-8; 629-965-1; 53250-83-2; 2-Chloro-4-methylsulfonylbenzoic acid; 2-chloro-4-methylsulphonylbenzoic acid; 2-chloro-4-methanesulfonylbenzoic acid; MFCD00216496; 2-chloro-4-(methylsulphonyl)benzoic acid; 2-Chloro-4-(methanesulfonyl)benzoic acid; Maybridge1_004133
| 分子量 | 234.66 |
|---|---|
| XLogP3 | 1.4 |
| 氢键供体数 | 1 |
| 氢键受体数 | 4 |
| 可旋转键数 | 2 |
| 精确质量 | 233.9753576 |
| 单同位素质量 | 233.9753576 |
| 拓扑极性表面积 | 79.8 |
| 重原子数 | 14 |
| 形式电荷 | 0 |
2-Chloro-4-methylsulfonylbenzoic acid · CAS 53250-83-2 · C8H7ClO4S. UNII PM45Q33ZR6.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.