8-Hydroxy-4-methyl-3-[(S)-1-methylpropyl]-6-oxo-6H-2-benzopyran-7-carboxylic acid (CAS 3615-05-2) — formula C15H16O5, molecular weight 276.28; category organic chemicals.
| CAS Number | 3615-05-2 |
|---|---|
| Molecular Formula | C15H16O5 |
| Molecular Weight | 276.28 |
| LogP | 2.1 |
| Category | Organic Chemicals |
8-Hydroxy-4-methyl-3-[(S)-1-methylpropyl]-6-oxo-6H-2-benzopyran-7-carboxylic acid is a carbon-based organic compound with CAS registry number 3615-05-2 and molecular formula C15H16O5 (molecular weight 276.28), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3615-05-2
Its molecular formula C15H16O5 comprises 15 C, 16 H, 5 O atoms.
Also known as: 8-Hydroxy-4-methyl-3-[(S)-1-methylpropyl]-6-oxo-6H-2-benzopyran-7-carboxylic acid · 壳二孢菌素
Category: organic chemicals
The CAS registry number of 8-Hydroxy-4-methyl-3-[(S)-1-methylpropyl]-6-oxo-6H-2-benzopyran-7-carboxylic acid is 3615-05-2.
Molecular formula C15H16O5, molecular weight 276.28.
It is also registered under: 8-Hydroxy-4-methyl-3-[(S)-1-methylpropyl]-6-oxo-6H-2-benzopyran-7-carboxylic acid, 壳二孢菌素.
Category: Organic Chemicals.
Independent reference data for 8-Hydroxy-4-methyl-3-[(S)-1-methylpropyl]-6-oxo-6H-2-benzopyran-7-carboxylic acid (CAS 3615-05-2), compiled from public chemistry databases.
| CAS 号 | 3615-05-2 |
|---|---|
| PubChem CID | 73486 |
| 分子式 | C15H16O5 |
| IUPAC 名称 | 3-[(2S)-butan-2-yl]-8-hydroxy-4-methyl-6-oxoisochromene-7-carboxylic acid |
| UNII（FDA） | CO17L3VWWJ |
| Molecular Weight | 276.28 |
|---|---|
| XLogP3 | 2.1 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 276.09977361 |
| Monoisotopic Mass | 276.09977361 |
| Topological Polar Surface Area | 83.8 |
| Heavy Atom Count | 20 |
Ascochitine; 3615-05-2; CO17L3VWWJ; NSC-114344; 6H-2-Benzopyran-7-carboxylic acid, 8-hydroxy-4-methyl-3-(1-methylpropyl)-6-oxo-, (S)-; RefChem:1074709; 8-Hydroxy-4-methyl-3-((1S)-1-methylpropyl)-6-oxo-6H-2-benzopyran-7-carboxylic acid; NSC114344; Aschchitine from B624868 K051; Ascochytin; Ascochitin; 6H-2-Benzopyran-7-carboxylic acid, 8-hydroxy-4-methyl-3-[(1S)-1-methylpropyl]-6-oxo-; 6H-2-BENZOPYRAN-7-CARBOXYLIC ACID, 8-HYDROXY-4-METHYL-3-((1S)-1-METHYLPROPYL)-6-OXO-; UNII-CO17L3VWWJ; orb2942982; CHEMBL1964740
壳二孢菌素 · CAS 3615-05-2 · C15H16O5. UNII CO17L3VWWJ.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 壳二孢菌素