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 chemical raw material in the food flavors category. 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. 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 | 典型应用领域：食品增香, 日化。规格/纯度：以批次 COA 为准。包装：25/50kg 编织袋, 20/25/50kg 纸板桶, 200kg 塑料桶, 1000kg IBC（以订单确认为准）。储存：阴凉干燥, 密封保存 |
| Category | Flavors |
Documented applications: 典型应用领域：食品增香, 日化。规格/纯度：以批次 COA 为准。包装：25/50kg 编织袋, 20/25/50kg 纸板桶, 200kg 塑料桶, 1000kg IBC（以订单确认为准）。储存：阴凉干燥, 密封保存.
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: 典型应用领域：食品增香, 日化。规格/纯度：以批次 COA 为准。包装：25/50kg 编织袋, 20/25/50kg 纸板桶, 200kg 塑料桶, 1000kg IBC（以订单确认为准）。储存：阴凉干燥, 密封保存.
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.