2-Butyl isothiocyanate (CAS No. 4426-79-3) 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 Flavors. Bulk quantities are available with COA; purity and packaging are subject to batch COA and order confirmation.
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The CAS number of 2-Butyl isothiocyanate is 4426-79-3.
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 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..
异硫氰酸仲丁酯 的 CAS 号为 4426-79-3，分子式 C5H9NS，分子量 115.05 g/mol。 UNII 126JI237AW; InChIKey TUFJIDJGIQOYFY-UHFFFAOYSA-N. Boiling Point: 69-70 °C (27 mm Hg); Density: 0.938-0.946; LogP: 2.81.
| CAS 号 | 4426-79-3 |
|---|---|
| PubChem CID | 78151 |
| 分子式 | C5H9NS |
| 分子量 | 115.05 g/mol |
| IUPAC 名称 | 2-isothiocyanatobutane |
| InChIKey | TUFJIDJGIQOYFY-UHFFFAOYSA-N |
| UNII（FDA） | 126JI237AW |
| FEMA 编号 | 4419 |
| JECFA 编号 | 1890 |
| Molecular Weight | 115.20 |
|---|---|
| XLogP3 | 2.8 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 115.04557046 |
| Monoisotopic Mass | 115.04557046 |
| Topological Polar Surface Area | 44.5 |
| Heavy Atom Count | 7 |
| Formal Charge | 0 |
| Boiling Point | 69-70 °C (27 mm Hg) |
|---|---|
| Density | 0.938-0.946 |
| LogP | 2.81 |
| Refractive Index | 1.490-1.497 |
| 法规与食品接触 | FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents Green No safety concern at current levels of intake when used as a flavouring agent ">RS 952-JECFA 69/124 ">FAS 60-JECFA 69/625 |
|---|
| 已通报的危害声明 | H226 (66.7%), H301 (66.7%), H314 (66.7%), H315 (33.3%), H319 (33.3%), H331 (66.7%), H335 (66.7%) |
|---|
sec-Butyl isothiocyanate; 4426-79-3; 2-Isothiocyanatobutane; 2-Butyl isothiocyanate; Butane, 2-isothiocyanato-; 2-Butylisothiocyanate; Isothiocyanic acid, sec-butyl ester; 1-Methylpropyl isothiocyanate; FEMA NO. 4419; DTXSID80863392; 126JI237AW; 2-BUTYLISOTHIOCYANATE [FHFI]; EINECS 224-609-8; RefChem:468093; DTXCID90812018; (+-)-2-BUTYL ISOTHIOCYANATE
CAS 号 4426-79-3；分子式 C5H9NS；分子量 115.05 g/mol。
sec-Butyl isothiocyanate, 4426-79-3, 2-Isothiocyanatobutane, 2-Butyl isothiocyanate, Butane, 2-isothiocyanato-, 2-Butylisothiocyanate.
已记录的法规收录：FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents; Green。
已通报的危害声明：H226, H301, H314, H315, H319。
Boiling Point: 69-70 °C (27 mm Hg); Density: 0.938-0.946; LogP: 2.81; Refractive Index: 1.490-1.497.
本页事实取自 PubChem（美国国家医学图书馆）与 Wikidata。批号相关的数据——含量、水分、粒度、包装、保质期——随批次 COA 出具，不在本页公布。
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.