Chemical Properties of 7-Norbornadienyl benzoate

7-Norbornadienyl benzoate

InChI
InChI=1S/C14H12O2/c15-14(12-4-2-1-3-5-12)16-13-10-6-7-11(13)9-8-10/h1-11,13H
InChI Key
NTELHPJRBBSUIJ-UHFFFAOYSA-N
Formula
C14H12O2
SMILES
O=C(OC1C2C=CC1C=C2)c1ccccc1
Molecular Weight1
212.25
Other Names
  • 7-Benzoyloxynorbornadiene
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Physical Properties

Property Value Unit Source
ω 0.4533 Relay (1.0) Calculated Property
ΔfG° 30.65 kJ/mol Joback Calculated Property
ΔfH°gas -60.45 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 28.11 kJ/mol Joback Calculated Property
ΔvapH° 83.47 kJ/mol Relay (1.0) Calculated Property
IE 8.74 eV Relay (1.0) Calculated Property
log10WS -3.52 Relay (1.0) Calculated Property
logPoct/wat 2.584 Crippen Calculated Property
McVol 161.480 ml/mol McGowan Calculated Property
Pc 2764.26 kPa Joback Calculated Property
Tboil 550.16 K Relay (1.0) Calculated Property
Tc 813.40 K Relay (1.0) Calculated Property
Tfus 332.61 K Relay (1.0) Calculated Property
Vc 0.590 m3/kmol Relay (1.0) Calculated Property

Pressure Dependent Properties

Property Value Unit Pressure (kPa) Source
Tboilr 400.50 ± 2.50 K 0.20 NIST

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [199.09; 536.50] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.02440e+02
Coefficient B1.35380e+00
Coefficient C-9.87560e-04
Coefficient D2.72700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 199.09 J/mol×K 273.00 Calculated Property
Cp,gas 264.98 J/mol×K 353.78 Calculated Property
Cp,gas 321.75 J/mol×K 434.56 Calculated Property
Cp,gas 370.27 J/mol×K 515.33 Calculated Property
Cp,gas 411.41 J/mol×K 596.11 Calculated Property
Cp,gas 446.03 J/mol×K 676.89 Calculated Property
Cp,gas 474.98 J/mol×K 757.67 Calculated Property
Cp,gas 499.14 J/mol×K 838.44 Calculated Property
Cp,gas 519.36 J/mol×K 919.22 Calculated Property
Cp,gas 536.50 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0020973; 0.0007961] Pa×s [345.93; 598.36] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-8.46324e+00
Coefficient B7.94300e+02
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.345.93
Temperature range, max.598.36
η 0.0020973 Pa×s 345.93 Calculated Property
η 0.0017655 Pa×s 373.98 Calculated Property
η 0.0015223 Pa×s 402.03 Calculated Property
η 0.0013383 Pa×s 430.07 Calculated Property
η 0.0011952 Pa×s 458.12 Calculated Property
η 0.0010814 Pa×s 486.17 Calculated Property
η 0.0009892 Pa×s 514.22 Calculated Property
η 0.0009133 Pa×s 542.27 Calculated Property
η 0.0008498 Pa×s 570.31 Calculated Property
η 0.0007961 Pa×s 598.36 Calculated Property

Similar Compounds

Cholesteryl benzoate. 7-(2-Methylbutyryl)-retronecine. 7-acetyl-9-(2-methylbutyryl) retronecine. Teferidine. 7-acetylretronecine. 7-tiglyl echinatine, diTMS, dihydro. 7-angelyl echinatine, diTMS, dihydro. 7-acetyl-9-(2,3-dimethylbutyryl) retronecine. Testosterone, 3-HFB, 17«beta»-PFB. Isocreatonotine. 7-(2-hydroxy-3-methylbutyryl)-retronecine. Inosine, 2',3',5'-tribenzoate. Hastacine. Bulgarsenine. Supinine, diTMS.

Find more compounds similar to 7-Norbornadienyl benzoate.

Sources

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