Chemical Properties of 3-Chlorophenyl isothiocyanate (CAS 2392-68-9)

3-Chlorophenyl isothiocyanate

PDF Excel Molecule Calculator
InChI
InChI=1S/C7H4ClNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H
InChI Key
WGXCKFMVBAOIFH-UHFFFAOYSA-N
Formula
C7H4ClNS
SMILES
S=C=Nc1cccc(Cl)c1
Molecular Weight1
169.63
CAS
2392-68-9
Other Names
  • Benzene, 1-chloro-3-isothiocyanato-
  • Isothiocyanic acid, 3-chlorophenyl ester
  • Isothiocyanic acid, m-chlorophenyl ester
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfH°gas 305.58 kJ/mol Joback Calculated Property
ΔvapH° 48.94 kJ/mol Joback Calculated Property
log10WS -3.07 Crippen Calculated Property
logPoct/wat 3.074 Crippen Calculated Property
McVol 115.700 ml/mol McGowan Calculated Property
Pc 3960.52 kPa Joback Calculated Property
Tboil 574.60 K Joback Calculated Property
Tc 845.67 K Joback Calculated Property

Similar Compounds

Benzene, 1-chloro-3-isocyanato-. 3,4-Dichlorophenyl isothiocyanate. 2-Chlorophenyl isothiocyanate. 2,5-Dichlorophenyl isothiocyanate. 3,5-Dichlorophenyl isothiocyanate. 4-Chlorophenyl isothiocyanate. Benzene, 1-chloro-2-isocyanato-. 2,4-Dichlorophenyl isothiocyanate. Benzene, 1,2-dichloro-4-isocyanato-. Isothiocyanic acid, 4-bromo-3-chlorophenyl ester. 3-Chloro-4-fluorophenyl isothiocyanate. Benzene, 1,4-dichloro-2-isocyanato-. 2,3,4-Trichlorophenyl isothiocyanate. Methanimidamide, N'-(3-chlorophenyl)-N,N-dimethyl-. N''-(3-chloro-phenyl)-N,N,N',N'-tetramethyl -guanidine.

Find more compounds similar to 3-Chlorophenyl isothiocyanate.

Sources

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.