Chemical Properties of Spiro-ether

Spiro-ether

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InChI
InChI=1S/C13H14O2/c1-2-3-4-5-7-12-8-10-13(15-12)9-6-11-14-13/h8,10,12H,6-7,9,11H2,1H3
InChI Key
NJLYCNZOTQCQMC-UHFFFAOYSA-N
Formula
C13H14O2
SMILES
CC#CC#CCC1C=CC2(CCCO2)O1
Molecular Weight1
202.25
Sources

Physical Properties

Property Value Unit Source
Δf 401.61 kJ/mol Joback Calculated Property
Δfgas 169.09 kJ/mol Joback Calculated Property
Δfus 36.52 kJ/mol Joback Calculated Property
Δvap 57.34 kJ/mol Joback Calculated Property
logPoct/wat 1.86 Crippen Calculated Property
Pc 3272.78 kPa Joback Calculated Property
Tboil 594.43 K Joback Calculated Property
Tc 864.18 K Joback Calculated Property
Tfus 551.59 K Joback Calculated Property
Vc 0.60 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 407.35 J/mol×K 594.43 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (ring) 2
=CH- (ring) 2
#C- 4
-CH2- 1
>C< (ring) 1
-CH3 1
>CH- (ring) 1
-CH2- (ring) 3

Similar Compounds

2,2,7,7-Tetramethyl-1,6-dioxaspiro{4,4]-non-3-ene. (Z)-Tibetin spiroether. (E)-2-(Hepta-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene. (E)-Tibetin spiroether. 7-(2,4-Hexadiynylidene)-1,6-dioxaspiro[4,4]nona-2,8-diene. (E)-Tonghaosu. cis-En-yn-dicycloether. (Z)-2-(Hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.4]non-3-ene. 2-(2,4-Hexadiynylidene)-1,6-dioxaspiro[4,4]non-3-ene, # 2. (E)-Ene-yne-dicyclo ether. En-yn-dicycloether. (E)-En-yn-dicycloether. 2-(2,4-Hexadiynylidene)-1,6-dioxaspiro[4,4]non-3-ene. 3,6;6,9-Bisepoxyfarnesa-1,7(14),10-triene. 9-epi-3,6,6,9-Bisepoxy-farnesa-1,7(14),10-triene.

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