Chemical Properties of Dimethylbicyclo[2.2.1]-2,5-heptadiene-2,3-dicarboxylate (CAS 947-57-9)

Dimethylbicyclo[2.2.1]-2,5-heptadiene-2,3-dicarboxylate

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InChI
InChI=1S/C11H12O4/c1-14-10(12)8-6-3-4-7(5-6)9(8)11(13)15-2/h3-4,6-7H,5H2,1-2H3
InChI Key
WFKWXJMEUOLYOS-UHFFFAOYSA-N
Formula
C11H12O4
SMILES
COC(=O)C1=C(C(=O)OC)C2C=CC1C2
Molecular Weight1
208.21
CAS
947-57-9
Other Names
  • 2,3-Bis(methoxycarbonyl)norbornadiene
  • 2,5-Norbornadiene-2,3-dicarboxylic acid, dimethyl ester
  • Bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylic acid, dimethyl ester
  • Dimethyl 2,5-norbornadiene-2,3-dicarboxylate
  • Dimethyl bicyclo[2.2.1]hepta-2,5-diene-2,3-dicarboxylate
  • Dimethyl ester of 2,5-norbornadien-2,3-dicarboxylic acid
  • Dimethyl norbornadiene-2,3-dicarboxylate
Sources

Physical Properties

Property Value Unit Source
Δf -276.04 kJ/mol Joback Calculated Property
Δfgas -527.91 kJ/mol Joback Calculated Property
Δfus 25.66 kJ/mol Joback Calculated Property
Δvap 60.30 kJ/mol Joback Calculated Property
logPoct/wat 0.835 Crippen Calculated Property
Pc 2906.11 kPa Joback Calculated Property
Tboil 419.00 ± 1.00 K NIST
Tc 843.61 K Joback Calculated Property
Tfus 416.97 K Joback Calculated Property
Vc 0.578 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 393.12 J/mol×K 629.69 Joback Calculated Property
η 0.0008177 Pa×s 629.69 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Bicyclo[2.2.1]-2,5-heptadiene-2,3-dicarboxylic acid. Methyl-.beta.-Cyclogeranate. (5a«alpha»,9a«alpha»)-4,5,5a,6,7,8,9,9a-octahydro-6,6,9a-trimethylnaphtho[1,2-c]furan-1(3H)-one (isodrimenin). Confertifolin. sedanenolide. Dimethyl 1,4-cyclohexadiene-1,2-dicarboxylate. Dimethyl (Z)-2-n-hexyl-3-methylbutendioate. Methyl valerenate. 2-Hydroxyguia-1(10),11-dien-15-oic acid. Methylmyrtenate. Methyl trans-2,3,3a,7a-tetrahydro-1H-indene-4-carboxylate. Methyl cis-2,3,3a,7a-tetrahydro-1H-indene-4-carboxylate. 3-Acetoxyamorpha-4,7(11)-dien-8-one. endo-Arbozyl tiglate. exo-Arbozyl angelate.

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