Chemical Properties of 3,6-Dimethyl-4-octyn-3,6-diol (CAS 78-66-0)

3,6-Dimethyl-4-octyn-3,6-diol

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InChI
InChI=1S/C10H18O2/c1-5-9(3,11)7-8-10(4,12)6-2/h11-12H,5-6H2,1-4H3
InChI Key
NUYADIDKTLPDGG-UHFFFAOYSA-N
Formula
C10H18O2
SMILES
CCC(C)(O)C#CC(C)(O)CC
Molecular Weight1
170.25
CAS
78-66-0
Other Names
  • 3,6-Dimethyl-4-octyne-3,6-diol
  • 3,6-Dimethyl-octin-4-diol-(3,6)
  • 3,6-dimethyloct-4-yne-3,6-diol
  • 4-Octyn-3,6-diol, 3,6-dimethyl-
  • 4-Octyne-3,6-diol, 3,6-dimethyl-
  • Surfynol 82
  • Surfynol 82, 82S
Sources

Physical Properties

Property Value Unit Source
Δf -31.84 kJ/mol Joback Calculated Property
Δfgas -299.39 kJ/mol Joback Calculated Property
Δfus 18.13 kJ/mol Joback Calculated Property
Δvap 70.77 kJ/mol Joback Calculated Property
logPoct/wat 1.312 Crippen Calculated Property
Pc 3100.18 kPa Joback Calculated Property
Tboil 484.20 K NIST
Tboil 375.50 ± 0.50 K NIST
Tc 801.74 K Joback Calculated Property
Tfus 435.04 K Joback Calculated Property
Vc 0.574 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 407.43 J/mol×K 615.1 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
#C- 2
-CH2- 2
-CH3 4
>C< 2
-OH (alcohol) 2

Similar Compounds

4,7-Dimethyl-5-decyne-4,7-diol. 2,4,7,9-Tetramethyl-5-decyn-4,7-diol. 3-Hexyne-2,5-diol, 2,5-dimethyl-. 3-Methyl-4-hexyn-3-ol. 4-Methyl-2-heptyn-4-ol. 3,6-Dimethyl-6-hepten-4-yn-3-ol. 4-Methyl-2-octyn-4-ol. 4-Heptyn-3-ol. 2,5-Dihydroperoxy-2,5-dimethylhex-3-yne. 4,6-Decadiyne-3,8-diol, 3,8-dimethyl-. 2-Methyl-5-octyn-4-ol. Dodec-5-yne-1,4-diol. 3-Decyn-2-ol. Meparfynol. 2-Heptyn-4-ol.

Find more compounds similar to 3,6-Dimethyl-4-octyn-3,6-diol.

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