4-(boc-amino)benzoic acid (CAS 66493-39-8) — formula C12H15NO4, molecular weight 237.25; category organic chemicals.
4-(boc-amino)benzoic acid is a carbon-based organic compound with CAS registry number 66493-39-8 and molecular formula C12H15NO4 (molecular weight 237.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 66493-39-8
Its molecular formula C12H15NO4 comprises 12 C, 15 H, 1 N, 4 O atoms.
Also known as: 4-(boc-amino)benzoic acid · N-Boc-4-aminobenzoic acid
Category: organic chemicals
The CAS registry number of 4-(boc-amino)benzoic acid is 66493-39-8.
Molecular formula C12H15NO4, molecular weight 237.25.
It is also registered under: 4-(boc-amino)benzoic acid, N-Boc-4-aminobenzoic acid.
Category: Organic Chemicals.
Public-database records for 4-(boc-amino)benzoic acid (CAS 66493-39-8), reproduced here for independent cross-checking.
| Reported hazard statements | H302 (28.6%), H315 (85.7%), H319 (85.7%), H335 (85.7%) |
|---|
H302 (28.6%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (85.7%): Causes skin irritation [Warning Skin corrosion/irritation]
| CAS Registry Number | 66493-39-8 |
|---|---|
| PubChem CID | 2755931 |
| 分子式 | C12H15NO4 |
| IUPAC 名称 | 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid |
4-{[(tert-butoxy)carbonyl]amino}benzoic acid; 4-(((tert-butoxy)carbonyl)amino)benzoic acid; RefChem:508728; 676-774-4; 66493-39-8; Boc-4-Abz-OH; 4-((tert-Butoxycarbonyl)amino)benzoic acid; 4-(Boc-amino)benzoic acid; 4-(tert-Butoxycarbonylamino)benzoic Acid; boc-4-aminobenzoic acid; 4-Tert-Butoxycarbonylamino-Benzoic Acid; 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic Acid; Boc-PABA-OH; 4-[(tert-butoxycarbonyl)amino]benzoic acid; MFCD00037428; 4-(boc-amino)-benzoic acid
| 分子量 | 237.25 |
|---|---|
| XLogP3 | 2.7 |
| 氢键供体数 | 2 |
| 氢键受体数 | 4 |
| 可旋转键数 | 4 |
| 精确质量 | 237.10010796 |
| 单同位素质量 | 237.10010796 |
| 拓扑极性表面积 | 75.6 |
| 重原子数 | 17 |
| 形式电荷 | 0 |
4-(boc-amino)benzoic acid · CAS 66493-39-8 · C12H15NO4.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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