Chemical Properties of (E)-2-((8R,8aS)-8,8a-Dimethyl-3,4,6,7,8,8a-hexahydronaphthalen-2(1H)-ylidene)propyl formate (CAS 352457-47-7)

(E)-2-((8R,8aS)-8,8a-Dimethyl-3,4,6,7,8,8a-hexahydronaphthalen-2(1H)-ylidene)propyl formate

InChI
InChI=1S/C16H24O2/c1-12(10-18-11-17)14-7-8-15-6-4-5-13(2)16(15,3)9-14/h6,11,13H,4-5,7-10H2,1-3H3/b14-12+
InChI Key
SAHHFGUGGFKBSR-WYMLVPIESA-N
Formula
C16H24O2
SMILES
CC(COC=O)=C1CCC2=CCCC(C)C2(C)C1
Molecular Weight1
248.36
CAS
352457-47-7
Other Names
  • Isovalencenyl formate
  • (E)-Eremophila-1(10),7(11)-dien-12-yl formate
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Physical Properties

Property Value Unit Source
ΔfusH° 24.66 kJ/mol Joback Calculated Property
logPoct/wat 4.022 Crippen Calculated Property
McVol 213.420 ml/mol McGowan Calculated Property
Inp [1800.00; 1800.00]   Show Hide
Inp 1800.00 NIST
Inp 1800.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [273.88; 742.09] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.44129e+02
Coefficient B1.93436e+00
Coefficient C-1.63784e-03
Coefficient D5.89700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 273.88 J/mol×K 273.00 Calculated Property
Cp,gas 361.33 J/mol×K 353.78 Calculated Property
Cp,gas 435.56 J/mol×K 434.56 Calculated Property
Cp,gas 498.46 J/mol×K 515.33 Calculated Property
Cp,gas 551.88 J/mol×K 596.11 Calculated Property
Cp,gas 597.68 J/mol×K 676.89 Calculated Property
Cp,gas 637.74 J/mol×K 757.67 Calculated Property
Cp,gas 673.92 J/mol×K 838.44 Calculated Property
Cp,gas 708.08 J/mol×K 919.22 Calculated Property
Cp,gas 742.09 J/mol×K 1000.00 Calculated Property

Similar Compounds

E-Eremophila-1(10),7(11)-dien-12-yl methyl ether. Spirovetiva-3,7(11)-dien-12-yl methyl ether. (E)-Eremophila-1(10),7(11)-dien-12-yl acetate. (E)-2-((8R,8aS)-8,8a-Dimethyl-3,4,6,7,8,8a-hexahydronaphthalen-2(1H)-ylidene)propan-1-ol. Methyl (E)-eremophila-1(10),7(11)-dien-12-oate. Spirovetiva-3,7(11)-dien-12-ol. Eremophila-1(10),7(11)-diene. Kolavelool (2 epimers). Kolavenol acetate. (E)-Isovalencenal [eremophila-1(10),7(11)-dien-12-al. (E)-Eremophila 1(10),7(11)-dien-12-al. (Z)-Isovalencenal [eremophila-1(10),7(11)-dien-12-al. (Z)-2-((8R,8aS)-8,8a-Dimethyl-3,4,6,7,8,8a-hexahydronaphthalen-2(1H)-ylidene)propanal. Methyl kolavenate. Spirovetiva-1(10),7(11)-diene.

Find more compounds similar to (E)-2-((8R,8aS)-8,8a-Dimethyl-3,4,6,7,8,8a-hexahydronaphthalen-2(1H)-ylidene)propyl formate.

Sources

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