Chemical Properties of Methane, isothiocyanato- (CAS 556-61-6)

Methane, isothiocyanato-

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InChI
InChI=1S/C2H3NS/c1-3-2-4/h1H3
InChI Key
LGDSHSYDSCRFAB-UHFFFAOYSA-N
Formula
C2H3NS
SMILES
CN=C=S
Molecular Weight1
73.12
CAS
556-61-6
Other Names
  • Isothiocyanic acid, methyl ester
  • Isothiocyanatomethane
  • Methyl isothiocyanate
  • Methyl mustard oil
  • Methyl thioisocyanate
  • Morton EP-161E
  • Trapex
  • Trapexide
  • Tropex
  • WN 12
  • CH3NCS
  • EP-161E
  • Isothiocyanate de methyle
  • Isotiocianato di metile
  • Methylisothiocyanaat
  • Methyl-isothiocyanat
  • Methylisothiokyanat
  • Methylsenfoel
  • MIT
  • Mitc
  • UN 2477
  • Vorlex (Nor-Am)
  • Vortex
  • Biomet 33
  • Degussa methyl isothiocyanate
  • MeNCS
  • Methane isothiocyanate
  • Methyl mustard
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Physical Properties

Property Value Unit Source
PAff 799.20 kJ/mol NIST
BasG 766.70 kJ/mol NIST
Δcsolid -1897.40 kJ/mol NIST
Δfgas 199.46 kJ/mol Joback Calculated Property
Δfsolid 79.60 ± 1.30 kJ/mol NIST
Δvap 37.30 kJ/mol NIST
IE [9.13; 9.37] eV Show Hide
IE 9.13 ± 0.15 eV NIST
IE 9.25 ± 0.03 eV NIST
IE 9.37 ± 0.02 eV NIST
log10WS -0.59 Crippen Calculated Property
logPoct/wat 0.719 Crippen Calculated Property
McVol 56.770 ml/mol McGowan Calculated Property
Pc 5190.64 kPa Joback Calculated Property
Inp [689.00; 742.00]   Show Hide
Inp 725.60 NIST
Inp 705.00 NIST
Inp 709.00 NIST
Inp Outlier 742.00 NIST
Inp 689.00 NIST
Inp 704.00 NIST
Inp 704.00 NIST
Inp 705.00 NIST
I [1228.00; 1243.00]   Show Hide
I 1243.00 NIST
I 1228.00 NIST
I 1228.00 NIST
Tboil 391.11 K Joback Calculated Property
Tc 617.59 K Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
ΔsubH 31.50 kJ/mol 265.50 NIST
ΔvapH 37.40 kJ/mol 350.50 NIST

Similar Compounds

Methyl isothiocyanate. Methane, isocyanato-. Methyl isoselenocyanate. Methyl isocyanide. CH3NCCCO. Methane, nitroso-. 1-Isothiocyanatoethylene. Methanamine, N,N-difluoro-. Ethane, isothiocyanato-. Thiocyanic acid, 2-propynyl ester. methan-d3-amine. Methylamine. Methoxymethyl isothiocyanate. Sulfur diimide, dimethyl-. (E)-CH3N=NCH3.

Find more compounds similar to Methane, isothiocyanato-.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.