3-METHYLTHIOPROPYL ISOTHIOCYANATE (CAS No. 505-79-3) is supplied by Jinan Shenghe Chemical Co., Ltd. with a typical purity of 按批次COA提供(不公开发布). Main applications include Organic Chemicals；Flavors. Bulk quantities are available with COA; purity and packaging are subject to batch COA and order confirmation.
| CAS Number | 505-79-3 |
|---|---|
| Molecular Formula | C5H9NS2 |
| Molecular Weight | 147.02 g/mol |
| Boiling Point | 254.00 °C. @ 760.00 mm Hg |
| LogP | 2.6 |
| Purity | 按批次COA提供(不公开发布) |
| Packaging | 按订单/批次确认(不公开发布) |
| Applications | Organic Chemicals；Flavors |
| Category | Organic Chemicals|Flavors |
Organic Chemicals；Flavors
COA (Certificate of Analysis) is provided with every batch. MSDS/technical data sheets and third-party test reports are available on request. Purity and packaging are subject to batch COA and order confirmation.
The CAS number of 3-METHYLTHIOPROPYL ISOTHIOCYANATE is 505-79-3.
Typical purity is 按批次COA提供(不公开发布), supplied in 按订单/批次确认(不公开发布), with COA provided.
Main applications include Organic Chemicals；Flavors.
Email info@591daili.com or reach us on WhatsApp with the product name, CAS number and required quantity; quotes within one business day. Supplier: Jinan Shenghe Chemical Co., Ltd..
3-METHYLTHIOPROPYL ISOTHIOCYANATE is identified by CAS 505-79-3, molecular formula C5H9NS2 and molecular weight 147.02 g/mol. UNII YTT13BN94Z; InChIKey LDKSCZJUIURGMW-UHFFFAOYSA-N. Boiling Point: 254.00 °C. @ 760.00 mm Hg; Boiling Point: 254 °C; Density: 1.099-1.105.
| CAS Registry Number | 505-79-3 |
|---|---|
| PubChem CID | 62351 |
| Molecular formula | C5H9NS2 |
| Molecular weight | 147.02 g/mol |
| IUPAC name | 1-isothiocyanato-3-methylsulfanylpropane |
| InChIKey | LDKSCZJUIURGMW-UHFFFAOYSA-N |
| UNII (FDA) | YTT13BN94Z |
| FEMA number | 3312 |
| JECFA number | 1564 |
| Molecular Weight | 147.3 |
|---|---|
| XLogP3 | 2.6 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 147.01764164 |
| Monoisotopic Mass | 147.01764164 |
| Topological Polar Surface Area | 69.8 |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Boiling Point | 254.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 254 °C |
| Density | 1.099-1.105 |
| Refractive Index | 1.560-1.566 |
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Savory No safety concern at current levels of intake when used as a flavouring agent |
|---|
| Reported hazard statements | H301 (92.7%), H311 (94.3%), H315 (95.4%), H319 (97%), H330 (94.3%), H335 (94.5%), H400 (88.8%), H410 (88.8%) |
|---|
H301 (92.7%): Toxic if swallowed [Danger Acute toxicity, oral]
H311 (94.3%): Toxic in contact with skin [Danger Acute toxicity, dermal]
Iberverin; 505-79-3; 3-(Methylthio)propyl isothiocyanate; 3-Methylthiopropyl isothiocyanate; PROPANE, 1-ISOTHIOCYANATO-3-(METHYLTHIO)-; FEMA No. 3312; 3-Methylmercaptopropyl isothiocyanate; Isothiocyanic acid, 3-(methylthio)propyl ester; YTT13BN94Z; DTXSID3047132; DTXCID1027132; RefChem:789637; 208-020-3; 3-(methylthio)propylisothiocyanate; 1-Isothiocyanato-3-(methylthio)propane; Ibervirin
CAS 505-79-3; molecular formula C5H9NS2; molecular weight 147.02 g/mol.
Iberverin, 505-79-3, 3-(Methylthio)propyl isothiocyanate, 3-Methylthiopropyl isothiocyanate, PROPANE, 1-ISOTHIOCYANATO-3-(METHYLTHIO)-, FEMA No. 3312.
Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents.
Hazard statements reported: H301, H311, H315, H319, H330.
Boiling Point: 254.00 °C. @ 760.00 mm Hg; Boiling Point: 254 °C; Density: 1.099-1.105; Refractive Index: 1.560-1.566.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-(甲硫基)丙基异硫氰酸酯