CAS Number4431-01-0
Synonyms3-BUTYLIDENE-4,5-DIHYDROPHTHALIDE; 3-BUTYLIDEN-4,5-DIHYDRO-3H-ISOBENZOFURAN-1-ONE; Ligustilide; 3-Butyliden-1-oxo-1.3.4.5-tetrahydro-isobenzofuran; Angelica Extract Powder; LIGUSTILIDE,Z; cis-ligustilide; Z-LIGUSTILIDE; (3Z)-3-Butylidene-4,5-dihydro-2-benzofuran-1(3H)-one; 3-butylidene-4,5-dihydro-3H-isobenzofuran-1-one
Molecular FormulaC12H14O2
Molecular Weight190.24
Purity≥96 (HPLC)%
Density1.1±0.1 g/cm3
Boiling Point377.9±11.0 °C at 760 mmHg
Melting Point297-298ºC
Appearanceliquid
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 4431-01-0 |
| Catalog No. | 2A-9030890 |
| Chinese Name | 蒿本内酯 |
| Synonyms | 3-BUTYLIDENE-4,5-DIHYDROPHTHALIDE; 3-BUTYLIDEN-4,5-DIHYDRO-3H-ISOBENZOFURAN-1-ONE; Ligustilide; 3-Butyliden-1-oxo-1.3.4.5-tetrahydro-isobenzofuran; Angelica Extract Powder; LIGUSTILIDE,Z; cis-ligustilide; Z-LIGUSTILIDE; (3Z)-3-Butylidene-4,5-dihydro-2-benzofuran-1(3H)-one; 3-butylidene-4,5-dihydro-3H-isobenzofuran-1-one |
| Molecular Formula | C12H14O2 |
| Molecular Weight | 190.24 |
| Purity | ≥96 (HPLC) |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 377.9±11.0 °C at 760 mmHg |
| Melting Point | 297-298ºC |
| Appearance | liquid |
| Storage Condition | -20°C; store under inert gas; avoid moisture (deco |
| Application | Ligustilide is an active component of Angelica sinensis. |
| PubChem ID | 329824991 |
| MDL Number | MFCD01861511 |
| SMILES | O=C(O/C1=C\CCC)C2=C1CCC=C2 |
| InChI | 1S/C12H14O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h5,7-8H,2-4,6H2,1H3/b11-8- |
| InChI Key | IQVQXVFMNOFTMU-FLIBITNWSA-N |
| NACRES Code | NA.25 |
| UNSPSC | 12352205 |
| MSDS | msds/30890_1_4431_01_0.pdf |
| Transport Info | Product name: Ligustilide |
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