Chemical Properties of 3-methyl-1,2-dithian-4-one

3-methyl-1,2-dithian-4-one

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InChI
InChI=1S/C5H8OS2/c1-4-5(6)2-3-7-8-4/h4H,2-3H2,1H3
InChI Key
HIPRPYCXKYSMOO-UHFFFAOYSA-N
Formula
C5H8OS2
SMILES
CC1SSCCC1=O
Molecular Weight1
148.25
Other Names
  • 1,2-Dithian-4-one, 3-methyl
  • 3-methyl-4-oxo-1,2-dithiane
  • 1,2-Dithian, 3-methyl-4-oxo
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Physical Properties

Property Value Unit Source
Δf -27.20 kJ/mol Joback Calculated Property
Δfgas -139.39 kJ/mol Joback Calculated Property
Δfus 7.36 kJ/mol Joback Calculated Property
Δvap 43.02 kJ/mol Joback Calculated Property
log10WS -1.96 Crippen Calculated Property
logPoct/wat 1.729 Crippen Calculated Property
McVol 104.720 ml/mol McGowan Calculated Property
Pc 4627.70 kPa Joback Calculated Property
Inp [1162.00; 1241.00]   Show Hide
Inp 1241.00 NIST
Inp 1220.00 NIST
Inp 1213.00 NIST
Inp 1216.00 NIST
Inp 1164.00 NIST
Inp 1175.00 NIST
Inp 1168.00 NIST
Inp 1162.00 NIST
Inp 1232.00 NIST
Inp 1232.00 NIST
Inp 1168.00 NIST
Inp 1241.00 NIST
Inp 1175.00 NIST
Inp 1162.00 NIST
I [1864.00; 1896.00]   Show Hide
I 1864.00 NIST
I 1896.00 NIST
I 1885.00 NIST
I 1896.00 NIST
I 1885.00 NIST
I 1864.00 NIST
Tboil 496.83 K Joback Calculated Property
Tc 760.16 K Joback Calculated Property
Tfus 388.61 K Joback Calculated Property
Vc 0.347 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [207.21; 276.26] J/mol×K [496.83; 760.16] Show Hide
Cp,gas 207.21 J/mol×K 496.83 Joback Calculated Property
Cp,gas 220.54 J/mol×K 540.72 Joback Calculated Property
Cp,gas 233.18 J/mol×K 584.61 Joback Calculated Property
Cp,gas 245.08 J/mol×K 628.49 Joback Calculated Property
Cp,gas 256.25 J/mol×K 672.38 Joback Calculated Property
Cp,gas 266.65 J/mol×K 716.27 Joback Calculated Property
Cp,gas 276.26 J/mol×K 760.16 Joback Calculated Property

Similar Compounds

cis-3,6-dimethyl-1,2-dithian-4-one. trans-3,6-dimethyl-1,2-dithian-4-one. 3,6-Dimethyl-1,2-dithian-4-one. bis(1-methyl-2-oxobutyl) disulfide. bis-(1-Methyl-2-oxobutyl) disulfide, #2. bis-(1-Methyl-2-oxobutyl) disulfide, #1. 2-(1-Methyl-2-oxopropyldithio)pentan-3-one, #2. 2-[(1-methyl-2-oxopropy1)-dithio]-3-pentanone. 6-methyl-1,2-dithian-4-one. trans-3,5-dimethyl-1,2-dithian-4-one. 1,2-Dithian-4-one, 3,5-dimethyl, #2 (E or Z). 3,5-Dimethyl-1,2-dithian-4-one. 1,2-Dithian-4-one, 3,5-dimethyl, #1 (E or Z). cis-3,5-dimethyl-1,2-dithian-4-one. 3-(1-Methyl-2-oxobutyldithio)pentan-2-one, #2.

Find more compounds similar to 3-methyl-1,2-dithian-4-one.

Sources

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