Chemical Properties of Hydantoin, 5-benzylidene-2-thio- (CAS 583-46-0)

Hydantoin, 5-benzylidene-2-thio-

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InChI
InChI=1S/C10H8N2OS/c13-9-8(11-10(14)12-9)6-7-4-2-1-3-5-7/h1-6H,(H2,11,12,13,14)/b8-6-
InChI Key
YXMBDTHHYFCMKP-VURMDHGXSA-N
Formula
C10H8N2OS
SMILES
O=C1NC(=S)NC1=Cc1ccccc1
Molecular Weight1
204.25
CAS
583-46-0
Other Names
  • 5-Benzylidene-2-thiohydantoin
  • 5-Benzylidene-2-thioguidanthion
  • 4-Imidazolidinone, 5-(phenylmethylene)-2-thioxo-
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Physical Properties

Property Value Unit Source
ΔfG° 379.13 kJ/mol Joback Calculated Property
ΔfH°gas 196.67 kJ/mol Joback Calculated Property
ΔfusH° 33.61 kJ/mol Joback Calculated Property
ΔvapH° 66.72 kJ/mol Joback Calculated Property
log10WS -3.02 Crippen Calculated Property
logPoct/wat 1.032 Crippen Calculated Property
McVol 146.420 ml/mol McGowan Calculated Property
Pc 4717.12 kPa Joback Calculated Property
Tboil 719.03 K Joback Calculated Property
Tc 1005.93 K Joback Calculated Property
Tfus 596.33 K Joback Calculated Property
Vc 0.531 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [353.46; 413.60] J/mol×K [719.03; 1005.93] Show Hide
Cp,gas 353.46 J/mol×K 719.03 Joback Calculated Property
Cp,gas 366.10 J/mol×K 766.85 Joback Calculated Property
Cp,gas 377.62 J/mol×K 814.66 Joback Calculated Property
Cp,gas 388.08 J/mol×K 862.48 Joback Calculated Property
Cp,gas 397.53 J/mol×K 910.30 Joback Calculated Property
Cp,gas 406.02 J/mol×K 958.11 Joback Calculated Property
Cp,gas 413.60 J/mol×K 1005.93 Joback Calculated Property

Similar Compounds

5-(2'-Hydroxybenzylidene)-2-thiohydantoin. 5-Benzylidenehydantoin. Pentazocine TMS derivative. Pentazocine, trimethylsilyl ether. 13-Cinnamoyloxymultiflorine. 13-cis-Cinnamoyloxy-17-oxolupanine. 7-(2-hydroxy-3-methylbutyryl)-retronecine. 13-cis-Cinnamoyloxylupanine. 13-Cis-cinnamoyloxylupanine. 13-Trans-cinnamoyloxylupanine. 13-trans-Cinnamoyloxylupanine. Etodolac, methylated. Spiro[2,5-cyclohexadiene-1,7'(1'H)-cyclopent[ij]isoquinolin]-4-one, 2',3',8',8'a-tetrahydro-5',6'-dimethoxy-1'-methyl-, (R)-. 13«alpha»-cis-Cinnamoyloxylupanine. 13«alpha»-trans-Cinnamoyloxylupanine.

Find more compounds similar to Hydantoin, 5-benzylidene-2-thio-.

Sources

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