Chemical Properties of Dehydroaromadendrene (CAS 85048-01-7)

Dehydroaromadendrene

InChI
InChI=1S/C15H24/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h6,10-14H,5,7-8H2,1-4H3/t10-,11?,12-,13?,14-/m1/s1
InChI Key
DJAYTQZJAJXFDU-DGOFFYKESA-N
Formula
C15H24
SMILES
CC1=CCC2C(C3C(C)CCC13)C2(C)C
Molecular Weight1
204.35
CAS
85048-01-7
Other Names
  • Dehydroaromadendrane
  • Aromadendr-9-ene
  • 9,10-Aromadendrene
  • (1a«alpha»,4a«alpha»,7«alpha»,7a«beta»,7b«alpha»)-(-)-1a,2,4a,5,6,7,7a,7b-octahydro-1,1,4,7-tetramethyl-1H-cycloprop[e]azulene
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Physical Properties

Property Value Unit Source
ΔfusH° 22.56 kJ/mol Joback Calculated Property
logPoct/wat 4.271 Crippen Calculated Property
McVol 185.330 ml/mol McGowan Calculated Property
Inp [1434.00; 1493.00]   Show Hide
Inp 1450.00 NIST
Inp 1442.00 NIST
Inp 1456.00 NIST
Inp 1459.00 NIST
Inp Outlier 1493.00 NIST
Inp 1463.00 NIST
Inp 1471.00 NIST
Inp 1459.00 NIST
Inp 1441.00 NIST
Inp 1456.00 NIST
Inp 1489.00 NIST
Inp 1434.00 NIST
Inp 1457.00 NIST
Inp 1459.00 NIST
Inp 1444.00 NIST
Inp 1455.00 NIST
Inp 1479.00 NIST
Inp 1462.00 NIST
Inp 1459.00 NIST
Inp 1457.00 NIST
Inp 1463.00 NIST
Inp Outlier 1493.00 NIST
Inp 1471.00 NIST
Tboil 527.25 K Relay (1.0) Calculated Property

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [242.52; 728.93] 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-1.81810e+02
Coefficient B1.95928e+00
Coefficient C-1.64664e-03
Coefficient D5.98100e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 242.52 J/mol×K 273.00 Calculated Property
Cp,gas 331.73 J/mol×K 353.78 Calculated Property
Cp,gas 407.74 J/mol×K 434.56 Calculated Property
Cp,gas 472.43 J/mol×K 515.33 Calculated Property
Cp,gas 527.70 J/mol×K 596.11 Calculated Property
Cp,gas 575.44 J/mol×K 676.89 Calculated Property
Cp,gas 617.54 J/mol×K 757.67 Calculated Property
Cp,gas 655.90 J/mol×K 838.44 Calculated Property
Cp,gas 692.40 J/mol×K 919.22 Calculated Property
Cp,gas 728.93 J/mol×K 1000.00 Calculated Property

Similar Compounds

Alloaromadendr-9-ene. 1,5-cis-Aromadendr-9-ene. .alpha.-Maaliene. Tricyclo[6.3.0.0(2,4)]undec-8-ene, 3,3,7,11-tetramethyl-. 1,1,4,7-Tetramethyl-1a,2,3,4,6,7,7a,7b-octahydro-1H-cyclopropa[e]azulene. cyclocopacamphene. (-)-Aristolene. 4-methyl-2-caren. cis-4-methylcarene. 4-[2,2-Dimethyl-3-(5-methylcyclopenta-1,4-dien-1-yl)-cyclopropyl]-butan- 2-one. epi-Bicyclophellandrene. 6-epi-«alpha»-Cubebene. «alpha»-Cubebene. Cubebene. 1a«alpha»,7«alpha»,7a«alpha»,7b«alpha»-1H-Cyclopropa[a]naphthalene, 1a,2,3,5,6,7,7a,7b-octahydro-1,1,7,7a-tetramethyl.

Find more compounds similar to Dehydroaromadendrene.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.
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