Chemical Properties of (Z)-«alpha»-Damascone (CAS 57549-93-6)

(Z)-«alpha»-Damascone

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InChI
InChI=1S/C13H20O/c1-5-6-12(14)11-9-10(2)7-8-13(11,3)4/h5-6,9,11H,7-8H2,1-4H3/b6-5-
InChI Key
XJPSXUXZJUPQNM-WAYWQWQTSA-N
Formula
C13H20O
SMILES
CC=CC(=O)C1C=C(C)CCC1(C)C
Molecular Weight1
192.30
CAS
57549-93-6
Other Names
  • cis-«alpha»-Damascone
  • «alpha»-Z-damascone
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Physical Properties

Property Value Unit Source
Δf 41.46 kJ/mol Joback Calculated Property
Δfgas -211.48 kJ/mol Joback Calculated Property
Δfus 18.67 kJ/mol Joback Calculated Property
Δvap 51.16 kJ/mol Joback Calculated Property
log10WS -3.66 Crippen Calculated Property
logPoct/wat 3.514 Crippen Calculated Property
McVol 176.140 ml/mol McGowan Calculated Property
Pc 2239.76 kPa Joback Calculated Property
Inp [1354.00; 1366.00]   Show Hide
Inp 1359.00 NIST
Inp 1354.00 NIST
Inp 1366.00 NIST
Inp 1361.00 NIST
Inp 1354.00 NIST
Inp 1366.00 NIST
Inp 1359.00 NIST
Tboil 574.13 K Joback Calculated Property
Tc 792.17 K Joback Calculated Property
Tfus 321.44 K Joback Calculated Property
Vc 0.665 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [438.46; 536.27] J/mol×K [574.13; 792.17] Show Hide
Cp,gas 438.46 J/mol×K 574.13 Joback Calculated Property
Cp,gas 457.12 J/mol×K 610.47 Joback Calculated Property
Cp,gas 474.66 J/mol×K 646.81 Joback Calculated Property
Cp,gas 491.22 J/mol×K 683.15 Joback Calculated Property
Cp,gas 506.92 J/mol×K 719.49 Joback Calculated Property
Cp,gas 521.90 J/mol×K 755.83 Joback Calculated Property
Cp,gas 536.27 J/mol×K 792.17 Joback Calculated Property

Similar Compounds

2-Buten-1-one, 1-(2,6,6-trimethyl-2-cyclohexen-1-yl)-, (E)-. «alpha»-Damascone. (Z)-«beta»-Damascone. 3-Oxo-«alpha»-damascone. (3S,4aR,5S,8aS)-4a,5-Dimethyl-3-(prop-1-en-2-yl)-2,3,4,4a,5,6-hexahydronaphthalen-1(8aH)-one. (+)-(5S,10S)-Eudesma-3,7(11)-dien-8-one. (+)-Eudesma-3,7(11)-dien-8-one. 24-Norursa-3,12-dien-11-one. 9,11-Eremophiladien-8-one. Eremophyla-9,11-dien-8-one. (+)-(5S,7S,10S)-Eudesma-3,11-dien-8-one. (+)-Eudesma-3,11-dien-8-one. Longiverbenone. «alpha»-Longipinen-2-one (Vulgarone B). Mustakone.

Find more compounds similar to (Z)-«alpha»-Damascone.

Sources

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