1-BOC-OCTAHYDRO-PYRROLO[3,4-B]PYRIDINE (CAS 159877-36-8) — formula C12H22N2O2, molecular weight 226.32; category organic chemicals.
| CAS Number | 159877-36-8 |
|---|---|
| Molecular Formula | C12H22N2O2 |
| Molecular Weight | 226.32 |
| LogP | 1.3 |
| Category | Organic Chemicals |
1-BOC-OCTAHYDRO-PYRROLO[3,4-B]PYRIDINE is a carbon-based organic compound with CAS registry number 159877-36-8 and molecular formula C12H22N2O2 (molecular weight 226.32), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 159877-36-8
Its molecular formula C12H22N2O2 comprises 12 C, 22 H, 2 N, 2 O atoms.
Also known as: 1-BOC-OCTAHYDRO-PYRROLO[3,4-B]PYRIDINE · 1-BOC-八氢-吡咯并[3,4-B]吡啶
Category: organic chemicals
The CAS registry number of 1-BOC-OCTAHYDRO-PYRROLO[3,4-B]PYRIDINE is 159877-36-8.
Molecular formula C12H22N2O2, molecular weight 226.32.
It is also registered under: 1-BOC-OCTAHYDRO-PYRROLO[3,4-B]PYRIDINE, 1-BOC-八氢-吡咯并[3,4-B]吡啶.
Category: Organic Chemicals.
Independent reference data for 1-BOC-OCTAHYDRO-PYRROLO[3,4-B]PYRIDINE (CAS 159877-36-8), compiled from public chemistry databases.
| CAS Registry Number | 159877-36-8 |
|---|---|
| PubChem CID | 22562202 |
| Molecular formula | C12H22N2O2 |
| IUPAC name | tert-butyl 2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridine-1-carboxylate |
| Molecular Weight | 226.32 |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 226.168127949 |
| Monoisotopic Mass | 226.168127949 |
| Topological Polar Surface Area | 41.6 |
| Heavy Atom Count | 16 |
1-Boc-octahydropyrrolo[3,4-b]pyridine; 1-Boc-octahydropyrrolo(3,4-b)pyridine; ert-butyl (4aR,7aR)-2,3,4,4a,5,6,7,7a-octahydropyrrolo(3,4-b)pyridine-1-carboxylate; ert-butyl (4aR,7aR)-2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridine-1-carboxylate; RefChem:430113; 605-192-5; 812-933-8; 186201-89-8; 159877-36-8; 1-Boc-octahydro-pyrrolo[3,4-b]pyridine; tert-butyl octahydro-1H-pyrrolo[3,4-b]pyridine-1-carboxylate; tert-butyl 2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridine-1-carboxylate; MFCD06858490; OCTAHYDRO-PYRROLO[3,4-B]PYRIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER; 181141-40-2; 1H-PYRROLO[3,4-B]PYRIDINE-1-CARBOXYLIC ACID, OCTAHYDRO-, 1,1-DIMETHYLETHYL ESTER
| Reported hazard statements | H302 (100%), H315 (100%), H319 (100%), H335 (100%), H318 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
1-BOC-OCTAHYDRO-PYRROLO[3,4-B]PYRIDINE · CAS 159877-36-8 · C12H22N2O2.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 1-BOC-八氢-吡咯并[3,4-B]吡啶