Chemical Properties of Germacrene A (CAS 28387-44-2)

Germacrene A

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InChI
InChI=1S/C14H22/c1-12(2)14-9-7-5-4-6-8-13(3)10-11-14/h5,7-8,14H,1,4,6,9-11H2,2-3H3/b7-5+,13-8+/t14-/m0/s1
InChI Key
XNNFTAIJLZPUAI-HNVHAEGFSA-N
Formula
C14H22
SMILES
C=C(C)C1CC=CCCC=C(C)CC1
Molecular Weight1
190.32
CAS
28387-44-2

Physical Properties

Property Value Unit Source
Δf 172.63 kJ/mol Joback Calculated Property
Δfgas -82.88 kJ/mol Joback Calculated Property
Δfus 14.92 kJ/mol Joback Calculated Property
Δvap 48.53 kJ/mol Joback Calculated Property
log10WS -4.90 Crippen Calculated Property
logPoct/wat 4.645 Crippen Calculated Property
McVol 184.360 ml/mol McGowan Calculated Property
Pc 2157.31 kPa Joback Calculated Property
Inp [1474.00; 1528.00]   Show Hide
Inp 1484.00 NIST
Inp 1493.00 NIST
Inp Outlier 1474.00 NIST
Inp 1509.00 NIST
Inp 1504.00 NIST
Inp 1510.00 NIST
Inp 1503.00 NIST
Inp 1503.00 NIST
Inp 1503.00 NIST
Inp 1505.00 NIST
Inp 1503.00 NIST
Inp 1501.00 NIST
Inp 1506.00 NIST
Inp 1503.00 NIST
Inp 1503.00 NIST
Inp 1506.00 NIST
Inp 1503.00 NIST
Inp Outlier 1480.00 NIST
Inp Outlier 1476.00 NIST
Inp 1504.00 NIST
Inp 1490.00 NIST
Inp 1506.00 NIST
Inp 1504.00 NIST
Inp 1483.00 NIST
Inp 1505.00 NIST
Inp Outlier 1476.00 NIST
Inp 1503.00 NIST
Inp 1505.00 NIST
Inp 1512.00 NIST
Inp 1489.00 NIST
Inp 1503.00 NIST
Inp 1505.00 NIST
Inp 1505.00 NIST
Inp 1505.00 NIST
Inp 1506.00 NIST
Inp 1487.00 NIST
Inp 1498.00 NIST
Inp 1503.00 NIST
Inp 1509.00 NIST
Inp 1500.00 NIST
Inp 1501.00 NIST
Inp 1491.00 NIST
Inp 1504.00 NIST
Inp 1515.00 NIST
Inp 1509.00 NIST
Inp 1503.00 NIST
Inp 1495.00 NIST
Inp 1510.00 NIST
Inp 1512.00 NIST
Inp 1485.00 NIST
Inp 1498.00 NIST
Inp 1503.00 NIST
Inp 1500.00 NIST
Inp 1499.00 NIST
Inp 1503.00 NIST
Inp 1503.00 NIST
Inp 1499.00 NIST
Inp 1507.00 NIST
Inp 1482.00 NIST
Inp 1508.00 NIST
Inp 1510.00 NIST
Inp 1505.00 NIST
Inp 1503.00 NIST
Inp 1503.00 NIST
Inp 1507.00 NIST
Inp 1504.00 NIST
Inp 1494.00 NIST
Inp 1510.00 NIST
Inp 1508.00 NIST
Inp 1505.00 NIST
Inp 1508.00 NIST
Inp 1504.00 NIST
Inp 1503.00 NIST
Inp Outlier 1528.00 NIST
Inp 1499.00 NIST
Inp 1505.00 NIST
Inp Outlier 1522.00 NIST
Inp 1499.00 NIST
Inp Outlier 1481.00 NIST
Inp Outlier 1479.00 NIST
Inp Outlier 1481.00 NIST
Inp 1505.00 NIST
Inp 1503.00 NIST
Inp 1496.00 NIST
Inp 1496.00 NIST
Inp 1501.00 NIST
Inp 1503.00 NIST
Inp 1495.00 NIST
Inp 1489.00 NIST
Inp 1491.00 NIST
Inp Outlier 1481.00 NIST
Inp 1496.00 NIST
Inp 1500.00 NIST
Inp 1509.00 NIST
Inp 1501.00 NIST
Inp 1505.00 NIST
Inp 1505.00 NIST
Inp 1509.00 NIST
Inp 1505.00 NIST
Inp 1509.00 NIST
Inp Outlier 1476.00 NIST
Inp 1501.00 NIST
Inp 1504.00 NIST
Inp 1505.00 NIST
Inp 1505.00 NIST
Inp 1509.00 NIST
Inp 1505.00 NIST
Inp 1502.00 NIST
Inp 1517.00 NIST
Inp 1495.00 NIST
Inp 1505.00 NIST
Inp 1508.00 NIST
Inp 1485.00 NIST
Inp 1503.00 NIST
Inp 1511.00 NIST
Inp 1509.00 NIST
Inp 1504.00 NIST
Inp 1509.00 NIST
Inp 1508.00 NIST
Inp 1505.00 NIST
Inp 1492.00 NIST
Inp 1511.00 NIST
Inp 1511.00 NIST
Inp 1505.00 NIST
Inp 1504.00 NIST
Inp 1503.00 NIST
Inp 1503.00 NIST
Inp 1504.00 NIST
Inp 1507.00 NIST
Inp 1506.00 NIST
Inp 1508.00 NIST
Inp 1509.00 NIST
Inp 1503.00 NIST
Inp 1502.00 NIST
Inp 1499.00 NIST
Inp 1502.00 NIST
Inp Outlier 1480.00 NIST
Inp 1495.00 NIST
Inp 1513.00 NIST
Inp 1513.00 NIST
Inp 1488.00 NIST
Inp 1498.00 NIST
Inp Outlier 1474.00 NIST
Inp 1503.00 NIST
Inp 1505.00 NIST
Inp 1509.00 NIST
Inp 1492.00 NIST
Inp 1508.00 NIST
Inp 1502.00 NIST
Inp 1488.00 NIST
Inp 1484.00 NIST
Inp 1506.00 NIST
I [1700.00; 1776.00]   Show Hide
I 1725.00 NIST
I 1745.00 NIST
I 1741.00 NIST
I 1741.00 NIST
I Outlier 1700.00 NIST
I 1738.00 NIST
I 1758.00 NIST
I 1757.00 NIST
I 1756.00 NIST
I 1747.00 NIST
I 1769.00 NIST
I 1743.00 NIST
I 1740.00 NIST
I 1776.00 NIST
I 1725.00 NIST
I 1735.00 NIST
I 1747.00 NIST
I 1758.00 NIST
I 1743.00 NIST
I Outlier 1700.00 NIST
I 1747.00 NIST
Tboil 556.21 K Joback Calculated Property
Tc 785.86 K Joback Calculated Property
Tfus 239.16 K Joback Calculated Property
Vc 0.674 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [446.33; 568.51] J/mol×K [556.21; 785.86] Show Hide
Cp,gas 446.33 J/mol×K 556.21 Joback Calculated Property
Cp,gas 470.16 J/mol×K 594.48 Joback Calculated Property
Cp,gas 492.58 J/mol×K 632.76 Joback Calculated Property
Cp,gas 513.60 J/mol×K 671.03 Joback Calculated Property
Cp,gas 533.26 J/mol×K 709.31 Joback Calculated Property
Cp,gas 551.56 J/mol×K 747.58 Joback Calculated Property
Cp,gas 568.51 J/mol×K 785.86 Joback Calculated Property

Similar Compounds

Helmintogermacrene. (+)-(7S)-Helmintogermacrene. (+)-Germacrene A. (+)-Helminthogermacrene. (R,1E,5E,9E)-1,5,9-Trimethyl-12-(prop-1-en-2-yl)cyclotetradeca-1,5,9-triene. D-Limonene. Limonene. Limonene. Cyclohexene, 1-methyl-4-(1-methylethenyl)-, (S)-. (+)-Axinyssene. «beta»-Bisabolene. Bisabolene. dimyrcene-II. Dimyrcene isomer # 3. Myrcene dimer.

Find more compounds similar to Germacrene A.

Sources

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