Chemical Properties of «alpha»-Thujenal (CAS 57129-54-1)

«alpha»-Thujenal

PDF Excel Molecule Calculator
InChI
InChI=1S/C10H14O/c1-7(2)10-4-3-8(6-11)9(10)5-10/h3,6-7,9H,4-5H2,1-2H3
InChI Key
YZNIFKFTGCAOST-UHFFFAOYSA-N
Formula
C10H14O
SMILES
CC(C)C12CC=C(C=O)C1C2
Molecular Weight1
150.22
CAS
57129-54-1
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
Δf 67.70 kJ/mol Joback Calculated Property
Δfgas -133.44 kJ/mol Joback Calculated Property
Δfus 11.23 kJ/mol Joback Calculated Property
Δvap 43.81 kJ/mol Joback Calculated Property
log10WS -2.21 Crippen Calculated Property
logPoct/wat 2.178 Crippen Calculated Property
McVol 127.310 ml/mol McGowan Calculated Property
Pc 3191.93 kPa Joback Calculated Property
Inp [1189.80; 1189.80]   Show Hide
Inp 1189.80 NIST
Inp 1189.80 NIST
Tboil 494.28 K Joback Calculated Property
Tc 705.65 K Joback Calculated Property
Tfus 302.52 K Joback Calculated Property
Vc 0.504 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [299.04; 374.07] J/mol×K [494.28; 705.65] Show Hide
Cp,gas 299.04 J/mol×K 494.28 Joback Calculated Property
Cp,gas 314.06 J/mol×K 529.51 Joback Calculated Property
Cp,gas 327.87 J/mol×K 564.74 Joback Calculated Property
Cp,gas 340.62 J/mol×K 599.97 Joback Calculated Property
Cp,gas 352.47 J/mol×K 635.20 Joback Calculated Property
Cp,gas 363.57 J/mol×K 670.42 Joback Calculated Property
Cp,gas 374.07 J/mol×K 705.65 Joback Calculated Property

Similar Compounds

(1aR,4aS,8aS)-4a,8,8-Trimethyl-1,1a,4,4a,5,6,7,8-octahydrocyclopropa[d]naphthalene-2-carbaldehyde. (E)-sesquithujen-12-al. trans-Thujene. Bicyclo[3.1.0]hex-2-ene, 2-methyl-5-(1-methylethyl)-. (1R,5R)-2-Methyl-5-((R)-6-methylhept-5-en-2-yl)bicyclo[3.1.0]hex-2-ene. 7-epi-Sesquithujene. (1S,5S)-2-Methyl-5-((R)-6-methylhept-5-en-2-yl)bicyclo[3.1.0]hex-2-ene. «alpha»-cedrenal. (+)-Barbatenal. Bicyclo[3.1.1]hept-2-ene-2-carboxaldehyde, 6,6-dimethyl-. (1R)-(-)-Myrtenal. Bicyclo[3.1.1]hept-2-ene-2-carboxaldehyde, 6,6-dimethyl-, (1S)-. Ylangenal. Cubebene. «alpha»-Cubebene.

Find more compounds similar to «alpha»-Thujenal.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.