1-Boc-pyrrolidine (CAS 86953-79-9) — formula C9H17NO2, molecular weight 171.24; category organic chemicals.
1-Boc-pyrrolidine is a carbon-based organic compound with CAS registry number 86953-79-9 and molecular formula C9H17NO2 (molecular weight 171.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 86953-79-9
Its molecular formula C9H17NO2 comprises 9 C, 17 H, 1 N, 2 O atoms.
Also known as: 1-Boc-pyrrolidine · tert-butyl 1-pyrrolidinecarboxylate
Category: organic chemicals
The CAS registry number of 1-Boc-pyrrolidine is 86953-79-9.
Molecular formula C9H17NO2, molecular weight 171.24.
It is also registered under: 1-Boc-pyrrolidine, tert-butyl 1-pyrrolidinecarboxylate.
Category: Organic Chemicals.
Public-database records for 1-Boc-pyrrolidine (CAS 86953-79-9), reproduced here for independent cross-checking.
| Reported hazard statements | H315 (100%), H319 (100%), H335 (97.6%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
| CAS Registry Number | 86953-79-9 |
|---|---|
| PubChem CID | 643455 |
| 分子式 | C9H17NO2 |
| IUPAC 名称 | tert-butyl pyrrolidine-1-carboxylate |
| UNII（FDA） | AM20110245 |
N-Boc-pyrrolidine; RefChem:436575; N-butyloxycarbonyl-pyrrolidine; 1-Boc-Pyrrolidine; 86953-79-9; tert-butyl pyrrolidine-1-carboxylate; pyrrolidine-1-carboxylic acid tert-butyl ester; tert-Butyl 1-pyrrolidinecarboxylate; MFCD00216581; Boc-pyrrolidine; n-tert-butoxycarbonylpyrrolidine; 1-tert-Butoxycarbonylpyrrolidine; tert-butylpyrrolidine-1-carboxylate; N-(tert-butoxycarbonyl) pyrrolidine; AC-26602; SY019195
| 分子量 | 171.24 |
|---|---|
| XLogP3 | 1.6 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 2 |
| 精确质量 | 171.125928785 |
| 单同位素质量 | 171.125928785 |
| 拓扑极性表面积 | 29.5 |
| 重原子数 | 12 |
| 形式电荷 | 0 |
1-Boc-pyrrolidine · CAS 86953-79-9 · C9H17NO2. UNII AM20110245.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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