4-Methoxy-2-methyl-2-butanethiol (CAS 94087-83-9) — formula C6H14OS, molecular weight 134.08 g/mol; category food flavors.
4-Methoxy-2-methyl-2-butanethiol (CAS 94087-83-9) is a chemical raw material in the food flavors category. Its molecular formula C6H14OS comprises 6 C, 14 H, 1 O, 1 S atoms. Its molecular weight is about 134.08 g/mol. Reported physicochemical data: boiling point around 159.00 to 160.00 °C. @ 760.00 mm Hg, LogP about 1.3. 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 | 94087-83-9 |
|---|---|
| Molecular Formula | C6H14OS |
| Molecular Weight | 134.08 g/mol |
| Boiling Point | 159.00 to 160.00 °C. @ 760.00 mm Hg |
| LogP | 1.3 |
| Applications | Fragrance Ingredients, Flavouring Agent, Flavoring Agents, 2-Butanethiol, 4-methoxy-2-methyl-: ACTIVE |
| Category | Flavors |
Documented applications: Fragrance Ingredients, Flavouring Agent, Flavoring Agents, 2-Butanethiol, 4-methoxy-2-methyl-: ACTIVE.
4-Methoxy-2-methyl-2-butanethiol is a flavoring compound with CAS registry number 94087-83-9 and molecular formula C6H14OS (molecular weight 134.08 g/mol), belonging to the food flavors segment of chemical raw materials.
CAS number: 94087-83-9
Its molecular formula C6H14OS comprises 6 C, 14 H, 1 O, 1 S atoms.
Also known as: 4-Methoxy-2-methyl-2-butanethiol · 4-methoxy-2-methylbutane-2-thiol
Category: food flavors
The CAS registry number of 4-Methoxy-2-methyl-2-butanethiol is 94087-83-9.
Molecular formula C6H14OS, molecular weight 134.08 g/mol.
It is also registered under: 4-Methoxy-2-methyl-2-butanethiol, 4-methoxy-2-methylbutane-2-thiol.
Recorded applications: Fragrance Ingredients, Flavouring Agent, Flavoring Agents, 2-Butanethiol, 4-methoxy-2-methyl-: ACTIVE.
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 4-Methoxy-2-methyl-2-butanethiol (CAS 94087-83-9), compiled from public chemistry databases.
| CAS Registry Number | 94087-83-9 |
|---|---|
| PubChem CID | 526195 |
| Molecular formula | C6H14OS |
| Molecular weight | 134.08 g/mol |
| IUPAC name | 4-methoxy-2-methylbutane-2-thiol |
| InChIKey | XVHGKKGBUDMTIQ-UHFFFAOYSA-N |
| UNII (FDA) | X72J2YFL9Y |
| ChEBI ID | CHEBI:193637 |
| FEMA number | 3785 |
| JECFA number | 548 |
| Molecular Weight | 134.24 |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 134.07653624 |
| Monoisotopic Mass | 134.07653624 |
| Topological Polar Surface Area | 10.2 |
| Heavy Atom Count | 8 |
| Boiling Point | 159.00 to 160.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 59 °C |
4-Methoxy-2-methyl-2-butanethiol; 4-Methoxy-2-methylbutane-2-thiol; 94087-83-9; 2-Butanethiol, 4-methoxy-2-methyl-; EINECS 301-977-9; X72J2YFL9Y; 4-Methoxy-2-methyl-2-mercaptobutane; DTXSID9052634; FEMA NO. 3785; 2-MERCAPTO-4-METHOXY-2-METHYLBUTANE; 4-METHOXY-2-METHYL-2-BUTANETHIOL [FHFI]; RefChem:524534; DTXCID6031207; 301-977-9; 4-methoxy-2-methyl-butane-2-thiol; 4-methoxy-2-methylbutanethiol-2
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Black Currant, Cat No safety concern at current levels of intake when used as a flavouring agent |
|---|
| Reported hazard statements | H226 (100%), H302 (91.8%) |
|---|
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
H302 (91.8%): Harmful if swallowed [Warning Acute toxicity, oral]
4-Methoxy-2-methyl-2-butanethiol is identified by CAS 94087-83-9, molecular formula C6H14OS and molecular weight 134.08 g/mol. UNII X72J2YFL9Y; ChEBI 193637; InChIKey XVHGKKGBUDMTIQ-UHFFFAOYSA-N. Boiling Point: 159.00 to 160.00 °C. @ 760.00 mm Hg; Boiling Point: 59 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.