Chemical Properties of 2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-4,4,7a-trimethyl-, (R)- (CAS 17092-92-1)

2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-4,4,7a-trimethyl-, (R)-

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InChI
InChI=1S/C11H16O2/c1-10(2)5-4-6-11(3)8(10)7-9(12)13-11/h7H,4-6H2,1-3H3/t11-/m0/s1
InChI Key
IMKHDCBNRDRUEB-NSHDSACASA-N
Formula
C11H16O2
SMILES
CC12CCCC(C)(C)C1=CC(=O)O2
Molecular Weight1
180.24
CAS
17092-92-1
Other Names
  • 2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-4,4,7a-trimethyl-
  • 4,4,7a-Trimethyl-5,6,7,7a-tetrahydro-1-benzofuran-2(4H)-one, (R)-
  • 5,6,7,7a-Tetrahydro-4,4-7a-trimethyl-2-(4H)-benzofuranone
  • 5,6,7,7a-Tetrahydro-4,4-7a-trimethyl-2-(4H)-benzofuranone (dihydroactinidiolide)
  • Actinidiolide, dihydro-
  • Dihydroactinidiolide
  • NSC 357087
  • dihydroactindiolide
Sources

Physical Properties

Property Value Unit Source
Δf -72.42 kJ/mol Joback Calculated Property
Δfgas -336.16 kJ/mol Joback Calculated Property
Δfus 9.94 kJ/mol Joback Calculated Property
Δvap 47.83 kJ/mol Joback Calculated Property
logPoct/wat 2.44 Crippen Calculated Property
Pc 3079.57 kPa Joback Calculated Property
Tboil 576.76 K Joback Calculated Property
Tc 823.41 K Joback Calculated Property
Tfus 394.92 K Joback Calculated Property
Vc 0.55 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 384.12 J/mol×K 576.76 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (ring) 1
>C=O (ring) 1
=CH- (ring) 1
=C< (ring) 1
>C< (ring) 2
-CH3 3
-CH2- (ring) 3

Similar Compounds

2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-4,4,7a-trimethyl-. Dihydroactinidioide. Loliolide. isololiolide. 3-oxo-3,4-dihydro-actinidiolide. 1,5,5-trimethyl-9-oxabicyclo[4.3]non-6-en-3-one. Actinidiolide. trans-actinidol. cis-actinidol. 5,8-epoxy-6-megastigmen-3,9-diol. 3,4-dihydro-3-hydroxyactinidol II. 3,4-dihydro-3-hydroxyactinidol I. (6R,7aR)-3,6-Dimethyl-5,6,7,7a-tetrahydrobenzofuran-2(4H)-one. (6R,7aS)-3,6-Dimethyl-5,6,7,7a-tetrahydrobenzofuran-2(4H)-one. 2(4H)-Benzofuranone, 5,6,7,7a-tetrahydro-3,6-dimethyl-.

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