tert-Butyl isothiocyanate
CAS Registry Number®
590-42-1
No image available.
CAS Name
tert-Butyl isothiocyanateMolecular Formula
C5H9NSMolecular Mass
115.20Cite this Page
tert-Butyl isothiocyanate. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=590-42-1 (retrieved ) (CAS RN: 590-42-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
140 °CMelting Point (1)
10.5 °C
Source(s)
- (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)
Other Names and Identifiers
InChI
InChI=1S/C5H9NS/c1-5(2,3)6-4-7/h1-3H3
InChIKey
InChIKey=ZFWFRTVIIMTOLY-UHFFFAOYSA-N
SMILES
N(C(C)(C)C)=C=S
Canonical SMILES
S=C=NC(C)(C)C
Other Names for this Substance
- Propane, 2-isothiocyanato-2-methyl-
- Isothiocyanic acid, tert-butyl ester
- 2-Isothiocyanato-2-methylpropane
- tert-Butyl isothiocyanate
- 1,1-Dimethylethyl isothiocyanate
