Chemical Properties of Allyl mercaptan (CAS 870-23-5)

Allyl mercaptan

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InChI
InChI=1S/C3H6S/c1-2-3-4/h2,4H,1,3H2
InChI Key
ULIKDJVNUXNQHS-UHFFFAOYSA-N
Formula
C3H6S
SMILES
C=CCS
Molecular Weight1
74.14
CAS
870-23-5
Other Names
  • 2-Propene-1-thiol
  • Allylthiol
  • CH2=CHCH2SH
  • 2-Propenyl-1-thiol
  • 2-Propenyl mercaptan
  • prop-2-ene-1-thiol
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Physical Properties

Property Value Unit Source
Δf 91.61 kJ/mol Joback Calculated Property
Δfgas 58.66 kJ/mol Joback Calculated Property
Δfus 6.29 kJ/mol Joback Calculated Property
Δvap 28.34 kJ/mol Joback Calculated Property
IE [9.25; 9.25] eV Show Hide
IE 9.25 eV NIST
IE 9.25 eV NIST
log10WS -1.00 Crippen Calculated Property
logPoct/wat 1.102 Crippen Calculated Property
McVol 65.180 ml/mol McGowan Calculated Property
Pc 5102.04 kPa Joback Calculated Property
Inp [575.00; 616.00]   Show Hide
Inp 603.00 NIST
Inp 603.00 NIST
Inp 580.00 NIST
Inp 583.00 NIST
Inp 579.00 NIST
Inp 593.00 NIST
Inp 612.00 NIST
Inp 594.00 NIST
Inp 594.00 NIST
Inp 616.00 NIST
Inp 575.00 NIST
Inp 593.00 NIST
Inp 575.00 NIST
Inp 603.00 NIST
I [863.00; 904.00]   Show Hide
I 901.00 NIST
I 904.00 NIST
I 891.00 NIST
I 887.00 NIST
I Outlier 863.00 NIST
I 895.00 NIST
I 901.00 NIST
I 904.00 NIST
I 895.00 NIST
Tboil [340.00; 363.00] K Show Hide
Tboil 340.70 K NIST
Tboil 342.00 K NIST
Tboil 340.00 ± 3.00 K NIST
Tboil 363.00 ± 6.00 K NIST
Tc 522.92 K Joback Calculated Property
Tfus 158.27 K Joback Calculated Property
Vc 0.238 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [90.91; 123.18] J/mol×K [327.58; 522.92] Show Hide
Cp,gas 90.91 J/mol×K 327.58 Joback Calculated Property
Cp,gas 96.96 J/mol×K 360.14 Joback Calculated Property
Cp,gas 102.73 J/mol×K 392.69 Joback Calculated Property
Cp,gas 108.23 J/mol×K 425.25 Joback Calculated Property
Cp,gas 113.46 J/mol×K 457.80 Joback Calculated Property
Cp,gas 118.45 J/mol×K 490.36 Joback Calculated Property
Cp,gas 123.18 J/mol×K 522.92 Joback Calculated Property

Similar Compounds

2-Buten-1-thiol. allyl hydrogen disulfide. Thiocyanic acid, 2-propenyl ester. Sulfide, allyl methyl. Disulfide, methyl 2-propenyl. Tetrasulfide, di-2-propenyl. Trisulfide, di-2-propenyl. Diallyl pentasulfide. Diallyl disulphide. Allyl methyl tetrasulfide. Trisulfide, methyl 2-propenyl. Methyl 2-propenyl pentasulfide. Diallyl sulfide. Allyl radical. 4,5-dithia-1-heptene.

Find more compounds similar to Allyl mercaptan.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.