Chemical Properties of 2-Heptanol, acetate (CAS 5921-82-4)

2-Heptanol, acetate

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InChI
InChI=1S/C9H18O2/c1-4-5-6-7-8(2)11-9(3)10/h8H,4-7H2,1-3H3
InChI Key
VJYWBLDDQZIGJI-UHFFFAOYSA-N
Formula
C9H18O2
SMILES
CCCCCC(C)OC(C)=O
Molecular Weight1
158.24
CAS
5921-82-4
Other Names
  • 1-Methylhexyl acetate
  • 2-Heptyl acetate
  • Acetic acid, hept-2-yl ester
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Physical Properties

Property Value Unit Source
Δf -211.46 kJ/mol Joback Calculated Property
Δfgas -479.17 kJ/mol Joback Calculated Property
Δfus 18.33 kJ/mol Joback Calculated Property
Δvap 44.40 kJ/mol Joback Calculated Property
log10WS -2.56 Crippen Calculated Property
logPoct/wat 2.518 Crippen Calculated Property
McVol 145.110 ml/mol McGowan Calculated Property
Pc 2431.44 kPa Joback Calculated Property
Inp [1019.00; 1054.00]   Show Hide
Inp 1034.00 NIST
Inp 1034.00 NIST
Inp Outlier 1054.00 NIST
Inp 1035.00 NIST
Inp 1022.00 NIST
Inp 1043.00 NIST
Inp 1022.00 NIST
Inp 1046.00 NIST
Inp 1019.00 NIST
Inp 1022.00 NIST
Inp 1047.00 NIST
Inp 1021.00 NIST
Inp 1023.00 NIST
Inp 1021.00 NIST
Inp 1024.00 NIST
Inp 1035.00 NIST
I [1250.00; 1266.00]   Show Hide
I 1255.00 NIST
I 1250.00 NIST
I 1255.00 NIST
I 1266.00 NIST
I 1266.00 NIST
Tboil 481.17 K Joback Calculated Property
Tc 658.49 K Joback Calculated Property
Tfus 248.35 K Joback Calculated Property
Vc 0.557 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [323.06; 397.15] J/mol×K [481.17; 658.49] Show Hide
Cp,gas 323.06 J/mol×K 481.17 Joback Calculated Property
Cp,gas 336.66 J/mol×K 510.72 Joback Calculated Property
Cp,gas 349.76 J/mol×K 540.28 Joback Calculated Property
Cp,gas 362.35 J/mol×K 569.83 Joback Calculated Property
Cp,gas 374.44 J/mol×K 599.38 Joback Calculated Property
Cp,gas 386.04 J/mol×K 628.93 Joback Calculated Property
Cp,gas 397.15 J/mol×K 658.49 Joback Calculated Property
η [0.0002272; 0.0047844] Pa×s [248.35; 481.17] Show Hide
η 0.0047844 Pa×s 248.35 Joback Calculated Property
η 0.0020429 Pa×s 287.15 Joback Calculated Property
η 0.0010682 Pa×s 325.96 Joback Calculated Property
η 0.0006412 Pa×s 364.76 Joback Calculated Property
η 0.0004246 Pa×s 403.56 Joback Calculated Property
η 0.0003022 Pa×s 442.37 Joback Calculated Property
η 0.0002272 Pa×s 481.17 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.63] kPa [344.44; 483.43] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.53108e+01
Coefficient B-4.15613e+03
Coefficient C-6.77930e+01
Temperature range, min.344.44
Temperature range, max.483.43
Pvap 1.33 kPa 344.44 Calculated Property
Pvap 2.95 kPa 359.88 Calculated Property
Pvap 6.03 kPa 375.33 Calculated Property
Pvap 11.50 kPa 390.77 Calculated Property
Pvap 20.69 kPa 406.21 Calculated Property
Pvap 35.37 kPa 421.66 Calculated Property
Pvap 57.80 kPa 437.10 Calculated Property
Pvap 90.80 kPa 452.54 Calculated Property
Pvap 137.76 kPa 467.99 Calculated Property
Pvap 202.63 kPa 483.43 Calculated Property

Similar Compounds

Acetic acid, dec-2-yl ester. 2-Acetoxytridecane. 2-Undecanol, acetate. 2-Nonyl acetate. 2-Octanol, acetate. 2-Tetracosanol, acetate. 2,16-Diacetoxyheptadecane. 2-Hexanol, acetate. 2,13-Diacetoxyheptadecane. (S,S)-2,14-diacetoxyheptadecane. 2,14-Diacetoxyheptadecane. 2,10-Diacetoxyheptadecane. 2,12-Diacetoxyheptadecane. (S,S)-2,13-diacetoxyheptadecane. (S,S)-2,12-diacetoxyheptadecane.

Find more compounds similar to 2-Heptanol, acetate.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.