Chemical Properties of 2(3H)-Benzofuranone, 6-ethenylhexahydro-3,6-dimethyl-7-(1-methylethenyl)-, [3S-(3«alpha»,3a«alpha»,6«alpha»,7«beta»,7a«beta»)]- (CAS 23527-07-3)

2(3H)-Benzofuranone, 6-ethenylhexahydro-3,6-dimethyl-7-(1-methylethenyl)-, [3S-(3«alpha»,3a«alpha»,6«alpha»,7«beta»,7a«beta»)]-

InChI
InChI=1S/C15H22O2/c1-6-15(5)8-7-11-10(4)14(16)17-13(11)12(15)9(2)3/h6,10-13H,1-2,7-8H2,3-5H3
InChI Key
LMNJALUUIMXUQQ-UHFFFAOYSA-N
Formula
C15H22O2
SMILES
C=CC1(C)CCC2C(C)C(=O)OC2C1C(=C)C
Molecular Weight1
234.33
CAS
23527-07-3
Other Names
  • 2(3H)-Benzofuranone, hexahydro-7-isopropenyl-3,6-dimethyl-6-vinyl-, (all-S)-
  • Saussurea lactone
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
ΔfusH° 25.11 kJ/mol Joback Calculated Property
logPoct/wat 3.342 Crippen Calculated Property
McVol 199.330 ml/mol McGowan Calculated Property
Inp [1806.30; 1806.30]   Show Hide
Inp 1806.30 NIST
Inp 1806.30 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [575.05; 692.00] J/mol×K [643.13; 872.16] Show Hide
Cp,gas 575.05 J/mol×K 643.13 Joback Calculated Property
Cp,gas 597.18 J/mol×K 681.30 Joback Calculated Property
Cp,gas 618.07 J/mol×K 719.47 Joback Calculated Property
Cp,gas 637.86 J/mol×K 757.65 Joback Calculated Property
Cp,gas 656.69 J/mol×K 795.82 Joback Calculated Property
Cp,gas 674.69 J/mol×K 833.99 Joback Calculated Property
Cp,gas 692.00 J/mol×K 872.16 Joback Calculated Property

Similar Compounds

(3R,3aR,5R,6R,7aR)-3,6-Dimethyl-5-(prop-1-en-2-yl)-6-vinylhexahydrobenzofuran-2(3H)-one. .beta.-Cyclodihydrocostunolide. Dihydrodehydrocostus lactone. 2(3H)-Benzofuranone, 6-ethenylhexahydro-6-methyl-3-methylene-7-(1-methylethenyl)-, [3aS-(3a«alpha»,6«alpha»,7«beta»,7a«beta»)]-. 6,12-Epoxyelema-1,3-diene. (3R,3aR,4aR,8aR,9aR)-3,8a-Dimethyl-5-methylene-3,3a,4,4a,5,6,9,9a-octahydronaphtho[2,3-b]furan-2(8aH)-one. (3R,3aR,4aR,8aS,9aR)-3,8a-Dimethyl-5-methylenedecahydronaphtho[2,3-b]furan-2(3H)-one. Aristolactone. 10-Epigazaniolide. Gazaniolide. Azuleno[4,5-b]furan-2,7-dione, 3,3a,4,5,9a,9b-hexahydro-3,6,9-trimethyl-, [3R-(3«alpha»,3a«beta»,9a«beta»,9b«alpha»)]-. Dehydrocostus lactone. .beta.-Cyclocostunolide. 5-Androstene-3beta,17beta-diol,16beta-ylacetic acid, lactone. Germacranolide callitris.

Find more compounds similar to 2(3H)-Benzofuranone, 6-ethenylhexahydro-3,6-dimethyl-7-(1-methylethenyl)-, [3S-(3«alpha»,3a«alpha»,6«alpha»,7«beta»,7a«beta»)]-.

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.
These property values are available through the Cheméo API. A free account gives you an access key.