2,4-Pentanedione,3-[(4-hydroxy-3-methoxyphenyl)methylene]- (CAS 91418-45-0) — formula C13H14O4, molecular weight 234.25; category organic chemicals.
| CAS Number | 91418-45-0 |
|---|---|
| Molecular Formula | C13H14O4 |
| Molecular Weight | 234.25 |
| LogP | 1.6 |
| Category | Organic Chemicals |
2,4-Pentanedione,3-[(4-hydroxy-3-methoxyphenyl)methylene]- is a carbon-based organic compound with CAS registry number 91418-45-0 and molecular formula C13H14O4 (molecular weight 234.25), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 91418-45-0
Its molecular formula C13H14O4 comprises 13 C, 14 H, 4 O atoms.
Also known as: 2,4-Pentanedione,3-[(4-hydroxy-3-methoxyphenyl)methylene]- · 3-(4-羟基-3-甲氧基亚苄基)戊烷-2,4-二酮
Category: organic chemicals
The CAS registry number of 2,4-Pentanedione,3-[(4-hydroxy-3-methoxyphenyl)methylene]- is 91418-45-0.
Molecular formula C13H14O4, molecular weight 234.25.
It is also registered under: 2,4-Pentanedione,3-[(4-hydroxy-3-methoxyphenyl)methylene]-, 3-(4-羟基-3-甲氧基亚苄基)戊烷-2,4-二酮.
Category: Organic Chemicals.
Independent reference data for 2,4-Pentanedione,3-[(4-hydroxy-3-methoxyphenyl)methylene]- (CAS 91418-45-0), compiled from public chemistry databases.
| CAS 号 | 91418-45-0 |
|---|---|
| PubChem CID | 294770 |
| 分子式 | C13H14O4 |
| IUPAC 名称 | 3-[(4-hydroxy-3-methoxyphenyl)methylidene]pentane-2,4-dione |
| UNII（FDA） | HMS2342P08 |
| Molecular Weight | 234.25 |
|---|---|
| XLogP3 | 1.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 234.08920892 |
| Monoisotopic Mass | 234.08920892 |
| Topological Polar Surface Area | 63.6 |
| Heavy Atom Count | 17 |
91418-45-0; 3-[(4-hydroxy-3-methoxyphenyl)methylene]-2,4-pentanedione; DTXSID30303970; 3-((4-Hydroxy-3-methoxyphenyl)methylene)-2,4-pentanedione; RefChem:272977; DTXCID30255102; 3-(4-Hydroxy-3-methoxybenzylidene)pentane-2,4-dione; 3-[(4-hydroxy-3-methoxyphenyl)methylidene]pentane-2,4-dione; MLS000544860; MFCD01568844; SMR000126617; 3-[(3-methoxy-4-oxidanyl-phenyl)methylidene]pentane-2,4-dione; NSC163816; cid_294770; SCHEMBL7523992; CHEMBL1508472
3-(4-羟基-3-甲氧基亚苄基)戊烷-2,4-二酮 · CAS 91418-45-0 · C13H14O4. UNII HMS2342P08.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.