[8'aR,(+)]-2',3',8',8'a-Tetrahydro-5',6'-dimethoxy-1'-methylspiro[2,5-cyclohexadiene-1,7'(1'H)-cyclopenta[ij]isoquinoline]-4-one (CAS 2128-60-1) — formula C19H21NO3, molecular weight 311.4; category organic chemicals.
| CAS Number | 2128-60-1 |
|---|---|
| Molecular Formula | C19H21NO3 |
| Molecular Weight | 311.4 |
| LogP | 2.5 |
| Category | Organic Chemicals |
[8'aR,(+)]-2',3',8',8'a-Tetrahydro-5',6'-dimethoxy-1'-methylspiro[2,5-cyclohexadiene-1,7'(1'H)-cyclopenta[ij]isoquinoline]-4-one is a carbon-based organic compound with CAS registry number 2128-60-1 and molecular formula C19H21NO3 (molecular weight 311.4), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2128-60-1
Its molecular formula C19H21NO3 comprises 19 C, 21 H, 1 N, 3 O atoms.
Also known as: [8'aR,(+)]-2',3',8',8'a-Tetrahydro-5',6'-dimethoxy-1'-methylspiro[2,5-cyclohexadiene-1,7'(1'H)-cyclopenta[ij]isoquinoline]-4-one · [8'aR,(+)]-2',3',8',8'a-四氢-5',6'-二甲氧基-1'-甲基螺[2,5-环己二烯-1,7'(1'H)-环戊[ij]异喹啉]-4-酮
Category: organic chemicals
The CAS registry number of [8'aR,(+)]-2',3',8',8'a-Tetrahydro-5',6'-dimethoxy-1'-methylspiro[2,5-cyclohexadiene-1,7'(1'H)-cyclopenta[ij]isoquinoline]-4-one is 2128-60-1.
Molecular formula C19H21NO3, molecular weight 311.4.
It is also registered under: [8'aR,(+)]-2',3',8',8'a-Tetrahydro-5',6'-dimethoxy-1'-methylspiro[2,5-cyclohexadiene-1,7'(1'H)-cyclopenta[ij]isoquinoline]-4-one, [8'aR,(+)]-2',3',8',8'a-四氢-5',6'-二甲氧基-1'-甲基螺[2,5-环己二烯-1,7'(1'H)-环戊[ij]异喹啉]-4-酮.
Category: Organic Chemicals.
Independent reference data for [8'aR,(+)]-2',3',8',8'a-Tetrahydro-5',6'-dimethoxy-1'-methylspiro[2,5-cyclohexadiene-1,7'(1'H)-cyclopenta[ij]isoquinoline]-4-one (CAS 2128-60-1), compiled from public chemistry databases.
| CAS 号 | 2128-60-1 |
|---|---|
| PubChem CID | 200480 |
| 分子式 | C19H21NO3 |
| IUPAC 名称 | (4R)-10,11-dimethoxy-5-methylspiro[5-azatricyclo[6.3.1.04,12]dodeca-1(12),8,10-triene-2,4'-cyclohexa-2,5-diene]-1'-one |
| UNII（FDA） | 860X46GII1 |
| Molecular Weight | 311.4 |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 311.15214353 |
| Monoisotopic Mass | 311.15214353 |
| Topological Polar Surface Area | 38.8 |
| Heavy Atom Count | 23 |
Pronuciferine; (+)-Pronuciferine; Milthanthine; Pronuciferin; N-Methylstepharine; N,O-Dimethylcrotonosine; 2128-60-1; 860X46GII1; CHEBI:42; RefChem:176247; (+/-)-pronuciferine; UNII-860X46GII1; PRONUCIFERINE, (+)-; CHEMBL237766; orb1695602; SCHEMBL29405850
[8'aR,(+)]-2',3',8',8'a-四氢-5',6'-二甲氧基-1'-甲基螺[2,5-环己二烯-1,7'(1'H)-环戊[ij]异喹啉]-4-酮 · CAS 2128-60-1 · C19H21NO3. UNII 860X46GII1.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: [8'aR,(+)]-2',3',8',8'a-四氢-5',6'-二甲氧基-1'-甲基螺[2,5-环己二烯-1,7'(1'H)-环戊[ij]异喹啉]-4-酮