(1S,βS)-1,4,4aα,5,6,7,8,8a-Octahydro-β,2,5,5,8aβ-pentamethyl-4-oxo-1β-naphthalenepentanoic acid methyl ester (CAS 1438-56-8) — formula C21H34O3, molecular weight 334.5; category organic chemicals.
| CAS Number | 1438-56-8 |
|---|---|
| Molecular Formula | C21H34O3 |
| Molecular Weight | 334.5 |
| LogP | 5.2 |
| Category | Organic Chemicals |
(1S,βS)-1,4,4aα,5,6,7,8,8a-Octahydro-β,2,5,5,8aβ-pentamethyl-4-oxo-1β-naphthalenepentanoic acid methyl ester is a carbon-based organic compound with CAS registry number 1438-56-8 and molecular formula C21H34O3 (molecular weight 334.5), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 1438-56-8
Its molecular formula C21H34O3 comprises 21 C, 34 H, 3 O atoms.
Also known as: (1S,βS)-1,4,4aα,5,6,7,8,8a-Octahydro-β,2,5,5,8aβ-pentamethyl-4-oxo-1β-naphthalenepentanoic acid methyl ester · (1S,βS)-1,4,4aα,5,6,7,8,8a-八氢-β,2,5,5,8aβ-五甲基-4-氧代-1β-萘戊酸甲酯
Category: organic chemicals
The CAS registry number of (1S,βS)-1,4,4aα,5,6,7,8,8a-Octahydro-β,2,5,5,8aβ-pentamethyl-4-oxo-1β-naphthalenepentanoic acid methyl ester is 1438-56-8.
Molecular formula C21H34O3, molecular weight 334.5.
It is also registered under: (1S,βS)-1,4,4aα,5,6,7,8,8a-Octahydro-β,2,5,5,8aβ-pentamethyl-4-oxo-1β-naphthalenepentanoic acid methyl ester, (1S,βS)-1,4,4aα,5,6,7,8,8a-八氢-β,2,5,5,8aβ-五甲基-4-氧代-1β-萘戊酸甲酯.
Category: Organic Chemicals.
Independent reference data for (1S,βS)-1,4,4aα,5,6,7,8,8a-Octahydro-β,2,5,5,8aβ-pentamethyl-4-oxo-1β-naphthalenepentanoic acid methyl ester (CAS 1438-56-8), compiled from public chemistry databases.
| CAS 号 | 1438-56-8 |
|---|---|
| PubChem CID | 12080777 |
| 分子式 | C21H34O3 |
| IUPAC 名称 | methyl (3S)-5-[(1S,4aS,8aR)-2,5,5,8a-tetramethyl-4-oxo-4a,6,7,8-tetrahydro-1H-naphthalen-1-yl]-3-methylpentanoate |
| Molecular Weight | 334.5 |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 6 |
| Exact Mass | 334.25079494 |
| Monoisotopic Mass | 334.25079494 |
| Topological Polar Surface Area | 43.4 |
| Heavy Atom Count | 24 |
(1S,βS)-1,4,4aα,5,6,7,8,8a-八氢-β,2,5,5,8aβ-五甲基-4-氧代-1β-萘戊酸甲酯 · CAS 1438-56-8 · C21H34O3.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: (1S,βS)-1,4,4aα,5,6,7,8,8a-八氢-β,2,5,5,8aβ-五甲基-4-氧代-1β-萘戊酸甲酯