Chemical Properties of 4-Methylmercaptoaniline (CAS 104-96-1)

4-Methylmercaptoaniline

Download as PDF file Download as Excel file Download as 2D mole file Predict properties

InChI
InChI=1S/C7H9NS/c1-9-7-4-2-6(8)3-5-7/h2-5H,8H2,1H3
InChI Key
YKFROQCFVXOUPW-UHFFFAOYSA-N
Formula
C7H9NS
SMILES
CSc1ccc(N)cc1
Molecular Weight1
139.22
CAS
104-96-1
Other Names
  • (4-(Methylthio)phenyl)amine
  • 4-(Methylthio)aniline
  • 4-(Methylthio)benzenamine
  • 4-Aminothioanisole
  • Aniline, p-(methylthio)-
  • Benzenamine, 4-(methylthio)-
  • NSC 75842
  • p-(Methylthio)aniline
  • p-Aminophenyl methyl sulfide
  • p-Aminothioanisole
  • p-Thioanisidine
  • p-Thiomethoxyaniline
Sources

Physical Properties

Property Value Unit Source
Δf 210.41 kJ/mol Joback Calculated Property
Δfgas 112.91 kJ/mol Joback Calculated Property
Δfus 16.87 kJ/mol Joback Calculated Property
Δvap 51.57 kJ/mol Joback Calculated Property
IE 7.60 eV NIST
IE 7.60 ± 0.01 eV NIST
logPoct/wat 1.99 Crippen Calculated Property
Pc 4444.44 kPa Joback Calculated Property
Tboil [412.00; 545.70] K Show Hide
Tboil 545.70 K NIST
Tboil 545.50 ± 0.50 K NIST
Tboil 413.20 K NIST
Tboil 412.00 K NIST
Tc 783.92 K Joback Calculated Property
Tfus 325.25 K Joback Calculated Property
Vc 0.40 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 231.94 J/mol×K 532.53 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=C< (ring) 2
-S- 1
-CH3 1
-NH2 1
=CH- (ring) 4

Similar Compounds

4-Aminothiophenol. 3-CH3SC6H4NH2. 4-(Methylthio)phenyl isothiocyanate. 4-Aminothiophenol, n,n,s-trimethyl-. 2-Methylmercaptoaniline. Benzene, (methylthio)-. 4-Aminophenyl methyl sufhone. Methyl 4-nitrophenyl sulphide. 4-Acetamidothioan1sole. 4-(Methylthio)thiophenol. 1,4-Benzenedithiol, s,s'-dimethyl-. Benzene, (ethylthio)-. 3-Aminobenzenethiol. Benzenethiol, 2-amino-. Benzene, (ethenylthio)-.

Find more compounds similar to 4-Methylmercaptoaniline.

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.