Chemical Properties of Disparlure (CAS 29804-22-6)

Disparlure

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InChI
InChI=1S/C19H38O/c1-4-5-6-7-8-9-10-11-15-18-19(20-18)16-13-12-14-17(2)3/h17-19H,4-16H2,1-3H3/t18-,19+/m0/s1
InChI Key
HFOFYNMWYRXIBP-RBUKOAKNSA-N
Formula
C19H38O
SMILES
CCCCCCCCCCC1OC1CCCCC(C)C
Molecular Weight1
282.50
CAS
29804-22-6
Other Names
  • Oxirane, 2-decyl-3-(5-methylhexyl)-, cis-
  • (.+/-cis-7,8-Epoxy-2-methyloctadecane
  • 2-Decyl-3-(5-methylhexyl)oxirane, (Z)-
  • cis-7,8-Epoxy-2-methyloctadecane
  • Epoxan
  • (Z)-7,8-Epoxy-2-methyloctadecane
  • Atralymon
  • (+/-)-cis-Disparlure
  • Oxirane, 2-decyl-3-(5-methylhexyl)-, (2R,3S)-rel-
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Physical Properties

Property Value Unit Source
Δf 73.58 kJ/mol Joback Calculated Property
Δfgas -520.31 kJ/mol Joback Calculated Property
Δfus 48.63 kJ/mol Joback Calculated Property
Δvap 61.61 kJ/mol Joback Calculated Property
log10WS -6.74 Crippen Calculated Property
logPoct/wat 6.501 Crippen Calculated Property
McVol 273.580 ml/mol McGowan Calculated Property
Pc 1152.22 kPa Joback Calculated Property
Inp [1990.00; 2032.00]   Show Hide
Inp 1990.00 NIST
Inp 2028.00 NIST
Inp 2032.00 NIST
Inp 2032.00 NIST
Inp 1990.00 NIST
Tboil 662.70 K Joback Calculated Property
Tc 832.43 K Joback Calculated Property
Tfus 329.16 K Joback Calculated Property
Vc 1.071 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [809.45; 921.83] J/mol×K [662.70; 832.43] Show Hide
Cp,gas 809.45 J/mol×K 662.70 Joback Calculated Property
Cp,gas 830.42 J/mol×K 690.99 Joback Calculated Property
Cp,gas 850.44 J/mol×K 719.28 Joback Calculated Property
Cp,gas 869.55 J/mol×K 747.57 Joback Calculated Property
Cp,gas 887.80 J/mol×K 775.86 Joback Calculated Property
Cp,gas 905.21 J/mol×K 804.15 Joback Calculated Property
Cp,gas 921.83 J/mol×K 832.43 Joback Calculated Property
η [0.0002885; 0.0033344] Pa×s [329.16; 662.70] Show Hide
η 0.0033344 Pa×s 329.16 Joback Calculated Property
η 0.0016515 Pa×s 384.75 Joback Calculated Property
η 0.0009768 Pa×s 440.34 Joback Calculated Property
η 0.0006499 Pa×s 495.93 Joback Calculated Property
η 0.0004694 Pa×s 551.52 Joback Calculated Property
η 0.0003599 Pa×s 607.11 Joback Calculated Property
η 0.0002885 Pa×s 662.70 Joback Calculated Property

Similar Compounds

trans-8,9-Epoxy-2-methyloctadecane. trans-9,10-Epoxy-2-methyloctadecane. (7R, 8S)-cis-7,8-epoxy-2-methyloctadecane [(+)-disparlure]. cis-8,9-Epoxy-2-methyloctadecane. trans-7,8-Epoxy-2-methyloctadecanea. 2-Methyl-Z-7,8-epoxyhexadecane. cis-9,10-Epoxy-2-methyloctadecane. trans-6,7-Epoxy-2-methyloctadecane. 2-(4-Methyl-pentyl)-3-decyl-oxirane. cis-6,7-Epoxy-2-methyloctadecane. cis-5,6-Epoxy-2-methyloctadecane. trans-5,6-Epoxy-2-methyloctadecane. 2-(5-Methyl-heptyl)-3-nonyl-oxirane. cis-10,11-epoxyhenicosane. (7R,8S)-cis-7,8-epoxy-octadecane [(+)-monachalure].

Find more compounds similar to Disparlure.

Sources

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