Chemical Properties of Vitispirane A

Vitispirane A

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InChI
InChI=1S/C13H20O/c1-10-6-5-8-12(3,4)13(10)9-7-11(2)14-13/h5-6,11H,1,7-9H2,2-4H3/t11?,13-/m0/s1
InChI Key
DUPDJVDPPBFBPL-YUZLPWPTSA-N
Formula
C13H20O
SMILES
C=C1C=CCC(C)(C)C12CCC(C)O2
Molecular Weight1
192.30
Other Names
  • Vitispirane 1
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Physical Properties

Property Value Unit Source
Δf 109.91 kJ/mol Joback Calculated Property
Δfgas -170.53 kJ/mol Joback Calculated Property
Δfus 13.81 kJ/mol Joback Calculated Property
Δvap 47.40 kJ/mol Joback Calculated Property
log10WS -3.83 Crippen Calculated Property
logPoct/wat 3.466 Crippen Calculated Property
McVol 169.580 ml/mol McGowan Calculated Property
Pc 2492.52 kPa Joback Calculated Property
Inp [1248.00; 1271.00]   Show Hide
Inp 1248.00 NIST
Inp 1271.00 NIST
I [1507.00; 1544.00]   Show Hide
I 1507.00 NIST
I 1526.00 NIST
I 1526.00 NIST
I 1508.00 NIST
I 1526.00 NIST
I 1544.00 NIST
I 1526.00 NIST
Tboil 548.48 K Joback Calculated Property
Tc 780.54 K Joback Calculated Property
Tfus 342.64 K Joback Calculated Property
Vc 0.631 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [430.91; 538.80] J/mol×K [548.48; 780.54] Show Hide
Cp,gas 430.91 J/mol×K 548.48 Joback Calculated Property
Cp,gas 451.73 J/mol×K 587.16 Joback Calculated Property
Cp,gas 471.06 J/mol×K 625.83 Joback Calculated Property
Cp,gas 489.17 J/mol×K 664.51 Joback Calculated Property
Cp,gas 506.32 J/mol×K 703.18 Joback Calculated Property
Cp,gas 522.78 J/mol×K 741.86 Joback Calculated Property
Cp,gas 538.80 J/mol×K 780.54 Joback Calculated Property

Similar Compounds

Vitispirane B. trans-Vitispirane. Vitispirane. cis-Vitispirane. 2,10,10-Trimethyl-6-methylene-1-oxaspiro[4.5]-dec-7-en-2-ol. (E)-Theaspirane. theaspirane. cis-theaspirane. 2,6,10,10-Tetramethyl- 1-oxaspiro[ 4.5]dec-6-ene-2,8-diol, TMS. Triamcinolone Acetonide. Triamcinolone diacetate. 2,10,10-Trimethyl6-methylene-1-oxaspiro[4.5]deca-2,7-diene. GA59, MeTMS. GA20(w1,2), MeTMS. GA95(1,2-didehydroGA20) isolactone, MeTMS.

Find more compounds similar to Vitispirane A.

Sources

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