tert-Butyl isothiocyanate
叔丁基异硫氰酸酯
Also known as: tert-Butyl isothiocyanate, TERT-BUTYL ISOTHIOCYANATE, 2-isothiocyanato-2-methylpropane, 2-isothiocyanato-2-methyl-propan, AKOS BC-1285, BUTYL ISOTHIOCYANATE, TERT-, Isothiocyanic acid, tert-butyl ester, MFCD00004816, Propane, 2-isothiocyanato-2-methyl-, T-BUTYL ISOTHIOCYANATE
tert-Butyl isothiocyanate (CAS 590-42-1) is a compound in the Organic Acids category listed in the Jingsj chemical database. It has the molecular formula C5H9NS and a molecular weight of 115.197 g/mol. It is also known as TERT-BUTYL ISOTHIOCYANATE, 2-isothiocyanato-2-methylpropane and 2-isothiocyanato-2-methyl-propan. Key properties include a melting point of 8-11 °C, a boiling point of 141.6±0.0 °C at 760 mmHg, a density of 0.9±0.1 g/cm3 and a flash point of 38.3±0.0 °C. GHS signal word: Danger. No supplier offers are currently listed; request a quote. Record last updated Aug 21, 2026.
- CAS No.
- 590-42-1
- Jingsj CID
- J-5626-9
- Molecular Formula
- C5H9NS
- Chinese Name
- 叔丁基异硫氰酸酯
- Molecular Weight
- 115.197 g/mol
- Category
- Organic Acids
- Last updated
- 8/21/2026
No offers for this compound yet.
Request a quotePhysicochemical Properties
| Melting Point | 8-11 °C |
|---|---|
| Boiling Point | 141.6±0.0 °C at 760 mmHg |
| Density | 0.9±0.1 g/cm3 |
| Flash Point | 38.3±0.0 °C |
GHS Safety & Compliance
Frequently Asked Questions
What is the CAS number of tert-Butyl isothiocyanate?
The CAS number of tert-Butyl isothiocyanate is 590-42-1.
What are the molecular formula and molecular weight of tert-Butyl isothiocyanate?
tert-Butyl isothiocyanate has molecular formula C5H9NS and molecular weight 115.197 g/mol.
Is tert-Butyl isothiocyanate hazardous?
tert-Butyl isothiocyanate has GHS signal word Danger.
Data compiled from public chemical databases and supplier catalogs; supplier offers are provided by suppliers.
Last updated:
How to cite: Jingsj. "tert-Butyl isothiocyanate (CAS 590-42-1)". Jingsj Chemical Database. https://www.jingsj.com/compound/J-5626-9 (accessed 2026-10-22).
Data for reference only; verify specifications, grades and regulatory status with suppliers before purchase.