Chemical Properties of Bicyclo[3.1.0]hexan-3-ol, 4-methyl-1-(1-methylethyl)-, (1«alpha»,3«beta»,4«beta»,5«alpha»)- (CAS 31187-53-8)

Bicyclo[3.1.0]hexan-3-ol, 4-methyl-1-(1-methylethyl)-, (1«alpha»,3«beta»,4«beta»,5«alpha»)-

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InChI
InChI=1S/C10H18O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-9,11H,4-5H2,1-3H3/t7-,8?,9+,10+/m1/s1
InChI Key
DZVXRFMREAADPP-ITRGKUQCSA-N
Formula
C10H18O
SMILES
CC1C(O)CC2(C(C)C)CC12
Molecular Weight1
154.25
CAS
31187-53-8
Other Names
  • Neoisothujyl alcohol
  • 1-Isopropyl-4-methylbicyclo[3.1.0]hexan-3-ol-, (1«alpha»,3«beta»,4«beta»,5«alpha»)-
  • Neoisothujol
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Physical Properties

Property Value Unit Source
Δf -5.35 kJ/mol Joback Calculated Property
Δfgas -287.08 kJ/mol Joback Calculated Property
Δfus 14.34 kJ/mol Joback Calculated Property
Δvap 52.20 kJ/mol Joback Calculated Property
log10WS -2.21 Crippen Calculated Property
logPoct/wat 2.049 Crippen Calculated Property
McVol 135.910 ml/mol McGowan Calculated Property
Pc 2956.90 kPa Joback Calculated Property
I [1694.00; 1694.00]   Show Hide
I 1694.00 NIST
I 1694.00 NIST
I 1694.00 NIST
Tboil 524.32 K Joback Calculated Property
Tc 714.97 K Joback Calculated Property
Tfus 299.58 K Joback Calculated Property
Vc 0.518 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [354.41; 435.75] J/mol×K [524.32; 714.97] Show Hide
Cp,gas 354.41 J/mol×K 524.32 Joback Calculated Property
Cp,gas 370.07 J/mol×K 556.10 Joback Calculated Property
Cp,gas 384.74 J/mol×K 587.87 Joback Calculated Property
Cp,gas 398.54 J/mol×K 619.65 Joback Calculated Property
Cp,gas 411.57 J/mol×K 651.42 Joback Calculated Property
Cp,gas 423.94 J/mol×K 683.20 Joback Calculated Property
Cp,gas 435.75 J/mol×K 714.97 Joback Calculated Property

Similar Compounds

[1S-(1«alpha»,3«alpha»,4«alpha»,5«alpha»)]-4-methyl-1-(1-methylethyl)bicyclo[3.1.0]hexan-3-ol. neo-Thujan-3-ol. Thujol. Iso-3-Thujol. Bicyclo[3.1.0]hexan-3-ol, 4-methyl-1-(1-methylethyl)-. neo-iso-Thujanol. iso-3-Thujanol. Neo iso-3-Thujol. cis-Thujanol. neo-Isothujan-3-ol. Neo-3-Thujol. Cubebol I. Cubebol II. trans-Sabinol. Bicyclo[4.1.0]heptan-3-ol, 4,7,7-trimethyl-, (1«alpha»,3«beta»,4«alpha»,6«alpha»)-.

Find more compounds similar to Bicyclo[3.1.0]hexan-3-ol, 4-methyl-1-(1-methylethyl)-, (1«alpha»,3«beta»,4«beta»,5«alpha»)-.

Sources

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