Chemical Properties of 3,4-Dimethoxyphenyl isothiocyanate (CAS 33904-04-0)

3,4-Dimethoxyphenyl isothiocyanate

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InChI
InChI=1S/C9H9NO2S/c1-11-8-4-3-7(10-6-13)5-9(8)12-2/h3-5H,1-2H3
InChI Key
LHPZZVZPOZPDDB-UHFFFAOYSA-N
Formula
C9H9NO2S
SMILES
COc1ccc(N=C=S)cc1OC
Molecular Weight1
195.24
CAS
33904-04-0
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Physical Properties

Property Value Unit Source
Δfgas 4.13 kJ/mol Joback Calculated Property
Δvap 54.49 kJ/mol Joback Calculated Property
log10WS -2.63 Crippen Calculated Property
logPoct/wat 2.438 Crippen Calculated Property
McVol 143.380 ml/mol McGowan Calculated Property
Pc 3110.57 kPa Joback Calculated Property
Tboil 632.75 K Joback Calculated Property
Tc 880.39 K Joback Calculated Property

Similar Compounds

3,4-Methylenedioxyphenyl isothiocyanate. Benzene, 5-isothiocyanato-1,2,3-trimethoxy-. 3-Methoxyphenyl isothiocyanate. 3,4,5-Trimethoxyphenyl cyanate. Benzenamine, 3,4-dimethoxy-. 4-Methoxyphenyl isothiocyanate. Benzene, 1,2-dimethoxy-4-nitro-. 2,5-Dimethoxyphenyl isothiocyanate. 2-Methoxyphenyl isothiocyanate. 5-Amino-2-methoxyphenol, N,N-methyl-, methyl ether. 5-Amino-2-methoxyphenol. 5-Amino-2-methoxyphenol, N,O-diacetyl-. 3,5-Dimethoxyphenyl isothiocyanate. 5-Amino-2-methoxyphenol, O,N-bis(trifluoroacetyl)-. 1,3-Benzodioxol-5-amine.

Find more compounds similar to 3,4-Dimethoxyphenyl isothiocyanate.

Sources

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