1-Isothiocyanatooctadecane
CAS Registry Number®
2877-26-1
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CAS Name
1-IsothiocyanatooctadecaneMolecular Formula
C19H37NSMolecular Mass
311.57Cite this Page
1-Isothiocyanatooctadecane. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=2877-26-1 (retrieved ) (CAS RN: 2877-26-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
140-142 °C @ Press: 3 x 10-3 TorrDensity (1)
0.8854 g/cm³ @ Temp: 20 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C19H37NS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19-21/h2-18H2,1H3
InChIKey
InChIKey=VJIRSSFEIRFISD-UHFFFAOYSA-N
SMILES
C(CCCCCCCCCC)CCCCCCCN=C=S
Canonical SMILES
S=C=NCCCCCCCCCCCCCCCCCC
Other Names for this Substance
- Octadecane, 1-isothiocyanato-
- Isothiocyanic acid, octadecyl ester
- 1-Isothiocyanatooctadecane
- Octadecyl isothiocyanate
