4-[(2-METHYLPIPERIDIN-1-YL)SULFONYL]BENZOIC ACID (CAS 70111-45-4) — formula C13H17NO4S, molecular weight 283.35; category organic chemicals.
| CAS Number | 70111-45-4 |
|---|---|
| Molecular Formula | C13H17NO4S |
| Molecular Weight | 283.35 |
| LogP | 1.9 |
| Category | Organic Chemicals |
4-[(2-METHYLPIPERIDIN-1-YL)SULFONYL]BENZOIC ACID is a carbon-based organic compound with CAS registry number 70111-45-4 and molecular formula C13H17NO4S (molecular weight 283.35), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 70111-45-4
Its molecular formula C13H17NO4S comprises 13 C, 17 H, 1 N, 4 O, 1 S atoms.
Also known as: 4-[(2-METHYLPIPERIDIN-1-YL)SULFONYL]BENZOIC ACID · 4-[(2-甲基哌啶-1-YL)磺酰]苯甲酸
Category: organic chemicals
The CAS registry number of 4-[(2-METHYLPIPERIDIN-1-YL)SULFONYL]BENZOIC ACID is 70111-45-4.
Molecular formula C13H17NO4S, molecular weight 283.35.
It is also registered under: 4-[(2-METHYLPIPERIDIN-1-YL)SULFONYL]BENZOIC ACID, 4-[(2-甲基哌啶-1-YL)磺酰]苯甲酸.
Category: Organic Chemicals.
Independent reference data for 4-[(2-METHYLPIPERIDIN-1-YL)SULFONYL]BENZOIC ACID (CAS 70111-45-4), compiled from public chemistry databases.
| CAS 号 | 70111-45-4 |
|---|---|
| PubChem CID | 2770975 |
| 分子式 | C13H17NO4S |
| IUPAC 名称 | 4-(2-methylpiperidin-1-yl)sulfonylbenzoic acid |
| UNII（FDA） | HMS1543F18 |
| Molecular Weight | 283.35 |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 283.08782920 |
| Monoisotopic Mass | 283.08782920 |
| Topological Polar Surface Area | 83.1 |
| Heavy Atom Count | 19 |
70111-45-4; 4-[(2-methylpiperidin-1-yl)sulfonyl]benzoic acid; 4-((2-Methylpiperidin-1-yl)sulfonyl)benzoic acid; DTXSID00377901; RefChem:286337; DTXCID10328929; 840-220-1; 4-(2-methylpiperidin-1-yl)sulfonylbenzoic acid; 4-(2-methylpiperidine-1-sulfonyl)benzoic acid; 4-[(2-methylpiperidyl)sulfonyl]benzoic acid; TimTec1_003296; Oprea1_178349; Oprea1_640005; HMS1543F18; VCA11145; SBB007416
| 已通报的危害声明 | H315 (100%), H319 (100%), H335 (100%) |
|---|
4-[(2-甲基哌啶-1-YL)磺酰]苯甲酸 · CAS 70111-45-4 · C13H17NO4S. UNII HMS1543F18.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 4-[(2-甲基哌啶-1-YL)磺酰]苯甲酸