Chemical Properties of (-)-(1R,6S,10S)-Amorpha-4,7(11)-dien-3-one

(-)-(1R,6S,10S)-Amorpha-4,7(11)-dien-3-one

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InChI
InChI=1S/C15H22O/c1-9(2)12-6-5-10(3)13-8-15(16)11(4)7-14(12)13/h7,10,13-14H,5-6,8H2,1-4H3/t10-,13-,14+/m0/s1
InChI Key
WCBCKXJLRYPWHZ-LEWSCRJBSA-N
Formula
C15H22O
SMILES
CC1=CC2C(=C(C)C)CCC(C)C2CC1=O
Molecular Weight1
218.33
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Physical Properties

Property Value Unit Source
Δf 75.46 kJ/mol Joback Calculated Property
Δfgas -277.46 kJ/mol Joback Calculated Property
Δfus 22.90 kJ/mol Joback Calculated Property
Δvap 55.26 kJ/mol Joback Calculated Property
log10WS -4.15 Crippen Calculated Property
logPoct/wat 3.904 Crippen Calculated Property
McVol 193.460 ml/mol McGowan Calculated Property
Pc 1991.21 kPa Joback Calculated Property
Inp [1676.00; 1676.00]   Show Hide
Inp 1676.00 NIST
Inp 1676.00 NIST
Inp 1676.00 NIST
Tboil 646.97 K Joback Calculated Property
Tc 877.91 K Joback Calculated Property
Tfus 354.27 K Joback Calculated Property
Vc 0.734 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [544.31; 655.99] J/mol×K [646.97; 877.91] Show Hide
Cp,gas 544.31 J/mol×K 646.97 Joback Calculated Property
Cp,gas 566.22 J/mol×K 685.46 Joback Calculated Property
Cp,gas 586.78 J/mol×K 723.95 Joback Calculated Property
Cp,gas 606.00 J/mol×K 762.44 Joback Calculated Property
Cp,gas 623.93 J/mol×K 800.93 Joback Calculated Property
Cp,gas 640.58 J/mol×K 839.42 Joback Calculated Property
Cp,gas 655.99 J/mol×K 877.91 Joback Calculated Property

Similar Compounds

Amorpha-4,7(11)-dien-8-one. cadina-4,10(15)-dien-3-one. 11-nor-Cadin-5-en-4-one, isomer B. (+)-(1R,6R,10S)-Amorpha-4,7(11)-dien-2-one. Valerenal. Amorph-4-en-3,8-dione. Muurol-4-en-3,8-dione. 13-nor-cis-Eudesm-6-en-8-one. 2-Methyl-4-(1-methylethyl)-2-cyclohexenone. 2(3H)-Naphthalenone, 4,4a,5,6,7,8-hexahydro-4a,5-dimethyl-3-(1-methylethylidene)-, (4ar-cis)-. Dehydrofukinone. Car-2-en-4-one. ent-(+)-Amorpha-4,11-diene. Amorpha-4,7(11)-diene. muuroladiene.

Find more compounds similar to (-)-(1R,6S,10S)-Amorpha-4,7(11)-dien-3-one.

Sources

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