Chemical Properties of 4-Bromo-2,6-dimethylphenyl isothiocyanate (CAS 77159-76-3)

4-Bromo-2,6-dimethylphenyl isothiocyanate

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InChI
InChI=1S/C9H8BrNS/c1-6-3-8(10)4-7(2)9(6)11-5-12/h3-4H,1-2H3
InChI Key
CAANWLMQHPUROR-UHFFFAOYSA-N
Formula
C9H8BrNS
SMILES
Cc1cc(Br)cc(C)c1N=C=S
Molecular Weight1
242.14
CAS
77159-76-3
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Physical Properties

Property Value Unit Source
ΔfH°gas 283.43 kJ/mol Joback Calculated Property
ΔvapH° 56.77 kJ/mol Joback Calculated Property
log10WS -4.50 Crippen Calculated Property
logPoct/wat 3.800 Crippen Calculated Property
McVol 149.140 ml/mol McGowan Calculated Property
Pc 3439.94 kPa Joback Calculated Property
Tboil 659.05 K Joback Calculated Property
Tc 928.74 K Joback Calculated Property

Similar Compounds

Benzene, 4-bromo-1-isothiocyanato-2-methyl-. 2,4,6-Trimethylphenyl isothiocyanate. Benzenamine, 4-bromo-2,6-dimethyl-. 2,6-Dimethylphenyl isothiocyanate. N,N,2,6-Tetramethylaniline,4-bromo-. 2,6-Dimethylphenyl isocyanate. 2,4-Dimethylphenyl isothiocyanate. Benzene, 1-isothiocyanato-2-methyl-. Benzenamine, 4-bromo-2-methyl-. Acetamide, N-(2,6-dimethylphenyl)-. 2-Ethyl-6-methylphenyl isothiocyanate. 2,4,5-Trimethylphenyl isothiocyanate. 2-Chloro-2',6'-acetoxylidide. 2,5-Dimethylphenyl isothiocyanate. 2,6-Diethylphenyl isothiocyanate.

Find more compounds similar to 4-Bromo-2,6-dimethylphenyl isothiocyanate.

Sources

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