Chemical Properties of 2-Norbornyl acetate (CAS 34640-76-1)

2-Norbornyl acetate

InChI
InChI=1S/C9H14O2/c1-6(10)11-9-5-7-2-3-8(9)4-7/h7-9H,2-5H2,1H3
InChI Key
YXNICIBZSREEPY-UHFFFAOYSA-N
Formula
C9H14O2
SMILES
CC(=O)OC1CC2CCC1C2
Molecular Weight1
154.21
CAS
34640-76-1
Other Names
  • Bicyclo[2.2.1]heptan-2-ol, acetate
  • Norbornyl acetate
  • Acetic acid, bicyclo[2.2.1]hept-2-yl ester
  • Bicyclo[2.2.1]hept-2-yl acetate
  • Norborneol acetate
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Physical Properties

Property Value Unit Source
ΔfH°gas -466.58 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 18.68 kJ/mol Joback Calculated Property
IE 9.46 eV Relay (1.0) Calculated Property
logPoct/wat 1.738 Crippen Calculated Property
McVol 123.390 ml/mol McGowan Calculated Property
Inp [1110.00; 1132.00]   Show Hide
Inp 1114.00 NIST
Inp 1114.30 NIST
Inp 1127.00 NIST
Inp 1132.00 NIST
Inp 1112.00 NIST
Inp 1110.00 NIST
Inp 1112.00 NIST
Inp 1127.00 NIST
Inp 1112.00 NIST
Inp 1114.00 NIST
I [1476.00; 1476.00]   Show Hide
I 1476.00 NIST
I 1476.00 NIST
I 1476.00 NIST
Tboil 462.06 K Relay (1.0) Calculated Property
Tfus 237.10 ± 0.60 K NIST

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [163.23; 459.67] 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-7.95500e+01
Coefficient B1.06972e+00
Coefficient C-7.09800e-04
Coefficient D1.79300e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 163.23 J/mol×K 273.00 Calculated Property
Cp,gas 217.99 J/mol×K 353.78 Calculated Property
Cp,gas 265.98 J/mol×K 434.56 Calculated Property
Cp,gas 307.75 J/mol×K 515.33 Calculated Property
Cp,gas 343.88 J/mol×K 596.11 Calculated Property
Cp,gas 374.92 J/mol×K 676.89 Calculated Property
Cp,gas 401.46 J/mol×K 757.67 Calculated Property
Cp,gas 424.05 J/mol×K 838.44 Calculated Property
Cp,gas 443.27 J/mol×K 919.22 Calculated Property
Cp,gas 459.67 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0019180; 0.0006895] Pa×s [237.10; 477.72] 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-8.28769e+00
Coefficient B4.81600e+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.237.10
Temperature range, max.477.72
η 0.0019180 Pa×s 237.10 Calculated Property
η 0.0015612 Pa×s 263.84 Calculated Property
η 0.0013198 Pa×s 290.57 Calculated Property
η 0.0011478 Pa×s 317.31 Calculated Property
η 0.0010201 Pa×s 344.04 Calculated Property
η 0.0009221 Pa×s 370.78 Calculated Property
η 0.0008450 Pa×s 397.52 Calculated Property
η 0.0007829 Pa×s 424.25 Calculated Property
η 0.0007319 Pa×s 450.99 Calculated Property
η 0.0006895 Pa×s 477.72 Calculated Property

Similar Compounds

endo-2-Norborneol acetate. exo-Tricyclo[6,2,1,0(2,6)]decan-8-«alpha»-ol, acetate. endo-Tricyclo[6,2,1,0(2,6)]decan-8-«alpha»-ol, acetate. endo-Tricyclo[6,2,1,0(2,6)]decan-8-«beta»-ol, acetate. exo-Tricyclo[6,2,1,0(2,6)]decan-8-«beta»-ol, acetate. Cyclohexanol, 5-methyl-2-(1-methylethyl)-, acetate, (1«alpha»,2«alpha»,5«beta»)-. Neoisomenthyl acetate. Acetic acid, p-menth-3-yl ester. Cyclohexanol, 5-methyl-2-(1-methylethyl)-, acetate. Cyclohexanol, 5-methyl-2-(1-methylethyl)-, acetate, (1«alpha»,2«beta»,5«beta»)-. Menthyl acetate. Cyclohexanol, 2-methyl-5-(1-methylethyl)-, acetate, (1«alpha»,2«beta»,5«alpha»)-. Neoisocarvomenthyl acetate. Neocarvomenthyl acetate. exo-Norborneol, trifluoroacetate.

Find more compounds similar to 2-Norbornyl acetate.

Sources

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