Chemical Properties of 3-Bromophenyl isothiocyanate (CAS 2131-59-1)

3-Bromophenyl isothiocyanate

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InChI
InChI=1S/C7H4BrNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H
InChI Key
ZMGMGHNOACSMQN-UHFFFAOYSA-N
Formula
C7H4BrNS
SMILES
S=C=Nc1cccc(Br)c1
Molecular Weight1
214.08
CAS
2131-59-1
Other Names
  • Isothiocyanic acid, m-bromophenyl ester
  • Benzene, 1-bromo-3-isothiocyanato-
  • m-Bromophenyl isothiocyanate
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Physical Properties

Property Value Unit Source
Δfgas 347.65 kJ/mol Joback Calculated Property
Δvap 50.99 kJ/mol Joback Calculated Property
log10WS -3.55 Crippen Calculated Property
logPoct/wat 3.183 Crippen Calculated Property
McVol 120.960 ml/mol McGowan Calculated Property
Pc 4546.92 kPa Joback Calculated Property
Tboil 603.33 K Joback Calculated Property
Tc 885.26 K Joback Calculated Property

Similar Compounds

3-Bromophenyl isocyanate. 4-Bromophenyl isothiocyanate. 2-Bromophenyl isocyanate. Formamidine, 3,3-dimethyl-1-(3-bromophenyl). N''-(3-bromo-phenyl)-N,N,N',N'-tetramethyl -guanidine. Benzenamine, 3-bromo-. 4-Bromophenyl isocyanate. Benzene, isothiocyanato-. Benzene, 1-bromo-3-nitro-. N'-(3-bromo-phenyl)-N,N-dimethyl-acetamidine. Benzenamine, 2-bromo-. Methanimidamide, N'-(2-bromophenyl)-N,N-dimethyl-. Isothiocyanic acid, 4-bromo-3-chlorophenyl ester. Benzylidene-(3-bromophenyl)-amine. p-bromobenzylidene-(3-bromophenyl)-amine.

Find more compounds similar to 3-Bromophenyl isothiocyanate.

Sources

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