Chemical Properties of Butane, 1,1'-sulfonylbis- (CAS 598-04-9)

Butane, 1,1'-sulfonylbis-

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InChI
InChI=1S/C8H18O2S/c1-3-5-7-11(9,10)8-6-4-2/h3-8H2,1-2H3
InChI Key
AIDFJGKWTOULTC-UHFFFAOYSA-N
Formula
C8H18O2S
SMILES
CCCCS(=O)(=O)CCCC
Molecular Weight1
178.29
CAS
598-04-9
Other Names
  • 1,1'-Sulphonylbisbutane
  • 1-(Butylsulfonyl)butane
  • Butyl sulfone
  • Di-n-butyl sulfone
  • Dibutyl sulfone
  • Dibutyl sulphone
  • NSC 2116
  • n-Butyl sulfone
Sources

Physical Properties

Property Value Unit Source
Δcsolid -5712.70 ± 1.90 kJ/mol NIST
Δf -452.06 kJ/mol Joback Calculated Property
Δfgas -509.80 ± 3.20 kJ/mol NIST
Δfsolid -610.20 ± 2.00 kJ/mol NIST
Δfus 27.85 kJ/mol Joback Calculated Property
Δsub 100.00 ± 2.00 kJ/mol NIST
Δvap 52.04 kJ/mol Joback Calculated Property
logPoct/wat 2.00 Crippen Calculated Property
Pc 2982.79 kPa Joback Calculated Property
Tboil 430.22 K Joback Calculated Property
Tc 592.13 K Joback Calculated Property
Tfus [316.00; 318.00] K Show Hide
Tfus 318.00 ± 2.00 K NIST
Tfus 318.00 ± 2.00 K NIST
Tfus 317.00 ± 3.00 K NIST
Tfus 317.30 ± 2.00 K NIST
Tfus 318.00 ± 3.00 K NIST
Tfus 316.00 ± 4.00 K NIST
Tfus 318.00 ± 2.00 K NIST
Tfus 317.00 ± 2.00 K NIST
Tfus 316.70 ± 0.60 K NIST
Vc 0.61 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 309.58 J/mol×K 430.22 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-S- 1
-CH2- 6
-CH3 2
=O 2

Similar Compounds

Butane, 1-(ethylsulfonyl)-. 2H-Thiopyran, tetrahydro-, 1,1-dioxide. Propane, 1,1'-sulfonylbis-. Butane, 1-(methylsulfonyl)-. Ethyl n-propyl sulfone. Butane, 1,1'-sulfinylbis-. Butane, 1-(ethylsulfinyl)-. Thiophene, tetrahydro-, 1,1-dioxide. Diisobutyl sulfone. Thiophene, tetrahydro-3-methyl-, 1,1-dioxide. 2H-Thiopyran, tetrahydro-, 1-oxide. Dipropyl sulfoxide. Butane, 1-(methylsulfinyl)-. N-hexasulfonyl-2-propanone. N-heptylsulfonylpropanone.

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