Chemical Properties of 5-Chloro-2,4-dimethoxyphenyl isothiocyanate (CAS 40046-27-3)

5-Chloro-2,4-dimethoxyphenyl isothiocyanate

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InChI
InChI=1S/C9H8ClNO2S/c1-12-8-4-9(13-2)7(11-5-14)3-6(8)10/h3-4H,1-2H3
InChI Key
BXJOFCAXBGIDIR-UHFFFAOYSA-N
Formula
C9H8ClNO2S
SMILES
COc1cc(OC)c(N=C=S)cc1Cl
Molecular Weight1
229.68
CAS
40046-27-3
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Physical Properties

Property Value Unit Source
ΔfH°gas -23.08 kJ/mol Joback Calculated Property
ΔvapH° 59.54 kJ/mol Joback Calculated Property
log10WS -3.31 Crippen Calculated Property
logPoct/wat 3.091 Crippen Calculated Property
McVol 155.620 ml/mol McGowan Calculated Property
Pc 2937.70 kPa Joback Calculated Property
Tboil 675.16 K Joback Calculated Property
Tc 926.36 K Joback Calculated Property

Similar Compounds

5-Chloro-2,4-dimethoxyphenyl isocyanate. Chlomethoxyfen. Benzenamine, 4-chloro-2,5-dimethoxy-. 2-Methoxyphenyl isothiocyanate. 2-Methoxy-5-nitrophenylisothiocyanate. 2,5-Dimethoxyphenyl isothiocyanate. Benzene, 2-chloro-1-methoxy-4-nitro-. 2-Naphthalenecarboxamide, N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxy-. Fumaric acid, monoamide, N-(2,4-dimethoxyphenyl)-, 2-chlorophenyl ester. Benzene, 1-ethoxy-2-isothiocyanato-. Fumaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, 2,4,6-trichlorophenyl ester. Glutaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, undecyl ester. (2-Methoxy-5-phenyl)phenylisothiocyanate. 2H-1,4-Benzoxazin-3(4H)-one. 2,5-Dimethyl-3'-chloro-4'-benzyloxyazobenzene.

Find more compounds similar to 5-Chloro-2,4-dimethoxyphenyl isothiocyanate.

Sources

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