Chemical Properties of Thiophene, 3,4-dichlorotetrahydro-, 1,1-dioxide (CAS 3001-57-8)

Thiophene, 3,4-dichlorotetrahydro-, 1,1-dioxide

InChI
InChI=1S/C4H6Cl2O2S/c5-3-1-9(7,8)2-4(3)6/h3-4H,1-2H2
InChI Key
JCUQWSIALJCIEE-UHFFFAOYSA-N
Formula
C4H6Cl2O2S
SMILES
O=S1(=O)CC(Cl)C(Cl)C1
Molecular Weight1
189.06
CAS
3001-57-8
Other Names
  • DAC PRD
  • 3,4-Dichlorosulfolane
  • 3,4-Dichlorotetrahydrothiophene 1,1-dioxide
  • 3,4-Dichlorothiolane 1,1-dioxide
  • Dichlorothiolane dioxide
  • DAC PRO
  • PRD
  • PRD experimental nematocide
  • Thiophene, tetrahydro-3,4-dichloro-, 1,1-dioxide
  • NSC 13391
  • NSC 27866
  • NSC 35959
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Physical Properties

Property Value Unit Source
ΔfusH° 20.42 kJ/mol Joback Calculated Property
logPoct/wat 0.630 Crippen Calculated Property
McVol 108.930 ml/mol McGowan Calculated Property

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [136.24; 301.16] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A5.95000e+00
Coefficient B5.56210e-01
Coefficient C-2.99900e-04
Coefficient D3.89000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 136.24 J/mol×K 273.00 Calculated Property
Cp,gas 166.91 J/mol×K 353.78 Calculated Property
Cp,gas 194.21 J/mol×K 434.56 Calculated Property
Cp,gas 218.26 J/mol×K 515.33 Calculated Property
Cp,gas 239.18 J/mol×K 596.11 Calculated Property
Cp,gas 257.10 J/mol×K 676.89 Calculated Property
Cp,gas 272.13 J/mol×K 757.67 Calculated Property
Cp,gas 284.40 J/mol×K 838.44 Calculated Property
Cp,gas 294.04 J/mol×K 919.22 Calculated Property
Cp,gas 301.16 J/mol×K 1000.00 Calculated Property

Similar Compounds

Thiosulfuric acid (H2S2O3), S-[2-[(tetrahydro-1,1-dioxido-3-thienyl)amino]ethyl] ester. Isothipendyl M (bis-nor-), acetylated. 5-(2-Hydroxypropionyl)-6,7-dimethyl-2,3-dihydro-1H-pyrrolizine. 3,4-Dihydro-3,3-dimethyl-2-p-tolyl-2H-1,4,2-benzoxazaphosphorine-2-oxide. .beta.-Tocopherol, O-tert.-butyldimethylsilyl-. Sparsomycin (3,8mg/ml). cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, methylboronate. 5-Propionyl-7-methyl-2,3-dihydro-1H-pyrrolizine. 4-[2-(4-Allyl-2,6-dimethoxy-phenoxy)-1-hydroxy-propyl]-2,6-dimethoxy-phenol, TPS. 5-Hydroxyuracil riboside, TMS. Beclomethasone, tetra-TMS. cis-Phenanthrene, 9,10-dihydro-9-methyl-9,10-diol, butylboronate. Mequitazine M (hydroxy-sulfoxide), acetylated. Quinapril desethyl - H2O Me (Quinaprilate - H2O Me). Furo[2,3-c]acridin-6(2H)-one, 1,11-dihydro-5-hydroxy-11-methyl-2-(1-methylethenyl)-, (-)-.

Find more compounds similar to Thiophene, 3,4-dichlorotetrahydro-, 1,1-dioxide.

Sources

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