Chemical Properties of Massoilactone (CAS 51154-96-2)

Massoilactone

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InChI
InChI=1S/C10H16O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h5,8-9H,2-4,6-7H2,1H3
InChI Key
NEDIAPMWNCQWNW-UHFFFAOYSA-N
Formula
C10H16O2
SMILES
CCCCCC1CC=CC(=O)O1
Molecular Weight1
168.23
CAS
51154-96-2
Other Names
  • 2H-Pyran-2-one, 5,6-dihydro-6-pentyl-, (R)-
  • (R)-(-)-Massoilactone
  • Massoia lactone
  • 6-Pentyl-5,6-dihydro-2H-pyran-2-one, (6R)-
  • 5,6-Dihydro-6-pentyl-(2H)-pyran-2-one-, (R)
  • Massoya lactone
  • Cocolactone
  • 5,6-Dihydro-6-pentyl-(2H)-pyran-2-one, massoi lactone
  • 2H-Pyran-2-one, 5,6-dihydro-6-pentyl-, (6R)-
  • 5-Pentylpent-2-en-5-olide
  • 6-pentyl-5,6-dihydropyran-2-one
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Physical Properties

Property Value Unit Source
Δf -120.98 kJ/mol Joback Calculated Property
Δfgas -407.33 kJ/mol Joback Calculated Property
Δfus 22.20 kJ/mol Joback Calculated Property
Δvap 47.33 kJ/mol Joback Calculated Property
log10WS -2.73 Crippen Calculated Property
logPoct/wat 2.438 Crippen Calculated Property
McVol 144.040 ml/mol McGowan Calculated Property
Pc 2738.28 kPa Joback Calculated Property
Inp [1433.00; 1483.00]   Show Hide
Inp 1433.00 NIST
Inp 1483.00 NIST
Inp 1483.00 NIST
Inp 1442.00 NIST
Inp 1446.00 NIST
Inp 1483.00 NIST
I [2241.00; 2260.00]   Show Hide
I 2241.00 NIST
I 2247.00 NIST
I 2247.00 NIST
I 2255.00 NIST
I 2241.00 NIST
I 2260.00 NIST
I 2241.00 NIST
Tboil 541.68 K Joback Calculated Property
Tc 755.53 K Joback Calculated Property
Tfus 305.39 K Joback Calculated Property
Vc 0.542 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [352.39; 442.14] J/mol×K [541.68; 755.53] Show Hide
Cp,gas 352.39 J/mol×K 541.68 Joback Calculated Property
Cp,gas 369.45 J/mol×K 577.32 Joback Calculated Property
Cp,gas 385.67 J/mol×K 612.96 Joback Calculated Property
Cp,gas 401.05 J/mol×K 648.61 Joback Calculated Property
Cp,gas 415.58 J/mol×K 684.25 Joback Calculated Property
Cp,gas 429.28 J/mol×K 719.89 Joback Calculated Property
Cp,gas 442.14 J/mol×K 755.53 Joback Calculated Property

Similar Compounds

2H-Pyran-2-one, 5,6-dihydro-6-pentyl-. 6-heptyl-5,6-dihydro-2H-pyran-2-one. 6-Undecyl-5,6-dihydro-2H-pyran-2-one. 6-Nonyl-5,6-dihydro-2H-pyran-2-one. C-12 massoia lactone. C-14 massoia lactone. 6-Propyl-5,6-dihydro-2H-pyran-2-one. 6-Ethyl-5,6-dihydro-2H-pyran-2-one. 13-Hexyloxacyclotridec-10-en-2-one. Fumaric acid, 4-octyl dodec-2-en-1-yl ester. trans-7-decen-5-olide. 2H-Pyran-2-one, tetrahydro-6-(2-pentenyl)-, (Z)-. 7-decen-5-olide. 9-Octadecenoic acid, 12-(acetyloxy)-, methyl ester, [R-(Z)]-. 9-Octadecenoic, d-12-acetoxy-, (z), butyl ester.

Find more compounds similar to Massoilactone.

Sources

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