3-Mercaptoheptyl acetate (CAS 548774-80-7) — formula C9H18O2S, molecular weight 190.10 g/mol.
3-Mercaptoheptyl acetate (CAS 548774-80-7) is a chemical raw material. Its molecular formula C9H18O2S comprises 9 C, 18 H, 2 O, 1 S atoms. Its molecular weight is about 190.10 g/mol. Reported physicochemical data: boiling point around 242 °C, LogP about 2.6. 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 | 548774-80-7 |
|---|---|
| Molecular Formula | C9H18O2S |
| Molecular Weight | 190.10 g/mol |
| Boiling Point | 242 °C |
| LogP | 2.6 |
| Packaging | 25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation) |
| Applications | 3-Mercaptoheptyl acetate (CAS 548774-80-7) is a chemical raw material. Specific applications are confirmed per inquiry with supporting documents available on request. 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 |
Documented applications: 3-Mercaptoheptyl acetate (CAS 548774-80-7) is a chemical raw material. Specific applications are confirmed per inquiry with supporting documents available on request. 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-Mercaptoheptyl acetate is a chemical compound with CAS registry number 548774-80-7 and molecular formula C9H18O2S (molecular weight 190.10 g/mol).
CAS number: 548774-80-7
Its molecular formula C9H18O2S comprises 9 C, 18 H, 2 O, 1 S atoms.
Also known as: 3-Mercaptoheptyl acetate · 乙酸3-巯基庚酯
The CAS registry number of 3-Mercaptoheptyl acetate is 548774-80-7.
Molecular formula C9H18O2S, molecular weight 190.10 g/mol.
It is also registered under: 3-Mercaptoheptyl acetate, 乙酸3-巯基庚酯.
Recorded applications: 3-Mercaptoheptyl acetate (CAS 548774-80-7) is a chemical raw material. Specific applications are confirmed per inquiry with supporting documents available on request. 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.
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-Mercaptoheptyl acetate (CAS 548774-80-7), compiled from public chemistry databases.
| CAS Number | 548774-80-7 |
|---|---|
| PubChem CID | 6430879 |
| Molecular Formula | C9H18O2S |
| Molecular Weight | 190.10 g/mol |
| IUPAC Name | 3-sulfanylheptyl acetate |
| InChIKey | JWESHEXXXWDVAQ-UHFFFAOYSA-N |
| UNII (FDA) | 4DR80W0YR1 |
| Molecular Weight | 190.31 |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 7 |
| Exact Mass | 190.10275099 |
| Monoisotopic Mass | 190.10275099 |
| Topological Polar Surface Area | 27.3 |
| Heavy Atom Count | 12 |
| Boiling Point | 242 °C |
|---|---|
| Density | 0.980-0.984 |
| Refractive Index | 1.457-1.463 |
3-MERCAPTOHEPTYL ACETATE; 548774-80-7; FEMA no. 4289; 1,3-Heptanedithiol, 1-acetate; 3-Mercaptoheptyl acetate [FHFI]; 1-Heptanol, 3-mercapto-, 1-acetate; 4DR80W0YR1; RefChem:502930; 3-sulfanylheptyl acetate; 3-mercaptoheptyl-acetate; UNII-4DR80W0YR1; 3-Mercapto-1-heptyl acetate; 3-sulanylheptyl acetate; SCHEMBL3244031; SCHEMBL31053838; DTXSID40970213
| Regulatory & food contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Candy, Onion, Tropical Fruit No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notifications | 100% (89 / 89) |
| GHS notifications | 100% (89 / 89) |
|---|
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 乙酸3-巯基庚酯