ethyl isothiocyanate


ethyl isothiocyanate; ethyl mustard oil; isothiocyanatoethane; isothiocyanic acid ethyl ester
Links:📏 NIST, 📖 PubMed,
📖Org. Chem., v. Richter, 1. Vol (Ethyl Mustard Oil); p. 470,
CAS:[542-85-8]
Formula:C3H5NS; 87.15 g/mol
InChiKey:HBNYJWAFDZLWRS-UHFFFAOYSA-N
SMILES:C(=NCC)=S
Molecular structure of ethyl isothiocyanate
Density:0.996 g/mL
Molar volume:87.5 mL/mol
Refractive index:1.510
Molecular refractive power:26.16 mL/mol
Dielectric constant:19.50
Dipole moment:3.31 D
Melting point:-5 °C
Boiling point:132 °C
Antoine equation
P(Torr) vs T(°C)
Vapour pressure vs temperature
Surface tension:33.04 dyn/cm
Log10 partition octanol / water:1.47
Immiscible with:
1,2,3-propanetriol,    1,3-propanediol,    formamide
Miscible with:
1,2-diethoxyethane,    2,4-pentanedione,    2-ethylhexanol,    3-methyl-1-butanol,    4-hydroxy-4-methylpentan-2-one,    4-methyl-2-pentanone,    N,N-dimethylaniline,    aniline,    benzene,    benzyl alcohol,    butanol,    butyl acetate,    ethanol,    ethyl benzoate,    furfuryl alcohol,    pyridine,    tetrachloromethane,    tetraethylene glycol dibutyl ether,    triethanolamine

Isomers

ethyl isothiocyanate
Molecular structure of ethyl isothiocyanate
ethyl thiocyanate
Molecular structure of ethyl thiocyanate
(methylthio)acetonitrile
Molecular structure of (methylthio)acetonitrile