3-Butylidenephthalide (CAS 551-08-6) — formula C12H12O2, molecular weight 188.08 g/mol; category food flavors.
3-Butylidenephthalide (CAS 551-08-6) is a food flavors. Its molecular formula C12H12O2 comprises 12 C, 12 H, 2 O atoms. Its molecular weight is about 188.08 g/mol. Reported physicochemical data: LogP about 3.2. Flavors are used to provide or enhance aroma in food and beverages, and must comply with food flavoring regulations. Widely used in beverages, confectionery, baking, dairy and convenience foods to build or complement flavor profiles. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.
| CAS Number | 551-08-6 |
|---|---|
| Molecular Formula | C12H12O2 |
| Molecular Weight | 188.08 g/mol |
| LogP | 3.2 |
| Packaging | 25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation) |
| Applications | confectionery, baking, dairy and convenience foods to build or complement flavor profiles. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering |
| Category | Flavors |
Documented applications: confectionery, baking, dairy and convenience foods to build or complement flavor profiles. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
3-Butylidenephthalide is a flavoring compound with CAS registry number 551-08-6 and molecular formula C12H12O2 (molecular weight 188.08 g/mol), belonging to the food flavors segment of chemical raw materials.
CAS number: 551-08-6
Its molecular formula C12H12O2 comprises 12 C, 12 H, 2 O atoms.
Also known as: 3-Butylidenephthalide · 3-正丁烯基苯酞； 3-亚丁基-1(3H)-异苯并呋喃酮
Category: food flavors
The CAS registry number of 3-Butylidenephthalide is 551-08-6.
Molecular formula C12H12O2, molecular weight 188.08 g/mol.
It is also registered under: 3-Butylidenephthalide, 3-正丁烯基苯酞； 3-亚丁基-1(3H)-异苯并呋喃酮.
Recorded applications: confectionery, baking, dairy and convenience foods to build or complement flavor profiles. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
Category: Flavors.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for 3-Butylidenephthalide (CAS 551-08-6), compiled from public chemistry databases.
| CAS Registry Number | 551-08-6 |
|---|---|
| PubChem CID | 62368 |
| Molecular formula | C12H12O2 |
| Molecular weight | 188.08 g/mol |
| IUPAC name | 3-butylidene-2-benzofuran-1-one |
| InChIKey | WMBOCUXXNSOQHM-UHFFFAOYSA-N |
| UNII (FDA) | NS00080374 |
| Molecular Weight | 188.22 |
|---|---|
| XLogP3 | 3.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 188.083729621 |
| Monoisotopic Mass | 188.083729621 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 14 |
3-butylidene-2-benzofuran-1-one; 1(3H)-ISOBENZOFURANONE, 3-BUTYLIDENE-; DTXSID9060281; RefChem:408849; DTXCID2041836; 3-Butylidene phthalide; Butylidene phthalide; 3-butylideneisobenzofuran-1-one; cis-Butylidenephthalide;(Z)-Butylidenephthalide; SCHEMBL290483; orb1222058; SCHEMBL11040192; SCHEMBL11040195; SCHEMBL11041324; SCHEMBL29372485; WMBOCUXXNSOQHM-UHFFFAOYSA-N
3-Butylidenephthalide is identified by CAS 551-08-6, molecular formula C12H12O2 and molecular weight 188.08 g/mol. UNII NS00080374; InChIKey WMBOCUXXNSOQHM-UHFFFAOYSA-N.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.