5,6,7,7a-tetrahydro-3,6-dimethyl-(4H)-benzofuran-2-one (CAS 13341-72-5) — formula C10H14O2, molecular weight 166.22; category organic chemicals.
| CAS Number | 13341-72-5 |
|---|---|
| Molecular Formula | C10H14O2 |
| Molecular Weight | 166.22 |
| Melting Point | 77 - 79 °C |
| Boiling Point | 261-263 °C (6 mm Hg) |
| LogP | 1.9 |
| Category | Organic Chemicals |
5,6,7,7a-tetrahydro-3,6-dimethyl-(4H)-benzofuran-2-one is a carbon-based organic compound with CAS registry number 13341-72-5 and molecular formula C10H14O2 (molecular weight 166.22), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 13341-72-5
Its molecular formula C10H14O2 comprises 10 C, 14 H, 2 O atoms.
Also known as: 5,6,7,7a-tetrahydro-3,6-dimethyl-(4H)-benzofuran-2-one · 薄荷内酯 · Mintlactone
Category: organic chemicals
The CAS registry number of 5,6,7,7a-tetrahydro-3,6-dimethyl-(4H)-benzofuran-2-one is 13341-72-5.
Molecular formula C10H14O2, molecular weight 166.22.
It is also registered under: 5,6,7,7a-tetrahydro-3,6-dimethyl-(4H)-benzofuran-2-one, 薄荷内酯, Mintlactone.
Category: Organic Chemicals.
Independent reference data for 5,6,7,7a-tetrahydro-3,6-dimethyl-(4H)-benzofuran-2-one (CAS 13341-72-5), compiled from public chemistry databases.
| CAS Registry Number | 13341-72-5 |
|---|---|
| PubChem CID | 94349 |
| Molecular formula | C10H14O2 |
| Molecular weight | 166.10 g/mol |
| IUPAC name | 3,6-dimethyl-5,6,7,7a-tetrahydro-4H-1-benzofuran-2-one |
| InChIKey | VUVQBYIJRDUVHT-UHFFFAOYSA-N |
| UNII (FDA) | EWW1JFM977 |
| ChEBI ID | CHEBI:195777 |
| FEMA number | 3764 |
| JECFA number | 1162 |
| Molecular Weight | 166.22 |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 166.099379685 |
| Monoisotopic Mass | 166.099379685 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 12 |
| Boiling Point | 261-263 °C (6 mm Hg) |
|---|---|
| Melting Point | 77 - 79 °C |
| Density | 1.058-1.063 |
| Refractive Index | 1.497-1.503 |
Mintlactone; Menthalactone; mint lactone; EWW1JFM977; 2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-3,6-dimethyl-; RefChem:527831; 5,6,7,7A-TETRAHYDRO-3,6-DIMETHYLBENZOFURAN-2(4H)-ONE; 236-390-6; 13341-72-5; 2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-3,6-dimethyl-, (6R,7aR)-; 2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-3,6-dimethyl-, (6R-trans)-; FEMA No. 3764; X2T3I06CWR; 3,6-dimethyl-5,6,7,7a-tetrahydro-4H-1-benzofuran-2-one; (+)-Isomintlactone; 5,6,7,7a-Tetrahydro-3,6-dimethyl-2(4H)-benzofuranone
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent No safety concern at current levels of intake when used as a flavouring agent ">RS 952-JECFA 69/148 |
|---|
| Reported hazard statements | H302 (100%) |
|---|
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Mintlactone is identified by CAS 13341-72-5, molecular formula C10H14O2 and molecular weight 166.10 g/mol. UNII EWW1JFM977; ChEBI 195777; InChIKey VUVQBYIJRDUVHT-UHFFFAOYSA-N. Boiling Point: 261-263 °C (6 mm Hg); Melting Point: 77 - 79 °C; Density: 1.058-1.063.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 薄荷内酯