Chemical Properties of 2-Hexen-1-ol, propanoate, (E)- (CAS 53398-80-4)

2-Hexen-1-ol, propanoate, (E)-

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InChI
InChI=1S/C9H16O2/c1-3-5-6-7-8-11-9(10)4-2/h6-7H,3-5,8H2,1-2H3/b7-6+
InChI Key
LPWKTEHEFDVAQS-VOTSOKGWSA-N
Formula
C9H16O2
SMILES
CCCC=CCOC(=O)CC
Molecular Weight1
156.22
CAS
53398-80-4
Other Names
  • (2E)-2-Hexenyl propionate
  • (E)-2-Hexen-1-ol, propanoate
  • (E)-2-Hexenyl propanoate
  • (E)-2-Hexenyl propionate
  • (E)-hex-2-enyl propionate
  • 2-Hexenyl propanoate
  • trans-2-Hexenyl n-propionate
  • trans-2-Hexenyl propionate
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Physical Properties

Property Value Unit Source
Δf -128.80 kJ/mol Joback Calculated Property
Δfgas -356.67 kJ/mol Joback Calculated Property
Δfus 22.05 kJ/mol Joback Calculated Property
Δvap 44.74 kJ/mol Joback Calculated Property
log10WS -2.31 Crippen Calculated Property
logPoct/wat 2.296 Crippen Calculated Property
McVol 140.810 ml/mol McGowan Calculated Property
Pc 2540.49 kPa Joback Calculated Property
Inp [1070.00; 1111.00]   Show Hide
Inp 1070.00 NIST
Inp 1088.70 NIST
Inp 1111.00 NIST
Inp 1085.00 NIST
Inp 1088.70 NIST
Inp 1085.00 NIST
I [1370.00; 1392.00]   Show Hide
I 1392.00 NIST
I 1370.00 NIST
I 1370.00 NIST
Tboil 485.77 K Joback Calculated Property
Tc 667.32 K Joback Calculated Property
Tfus 258.27 K Joback Calculated Property
Vc 0.543 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [306.02; 375.62] J/mol×K [485.77; 667.32] Show Hide
Cp,gas 306.02 J/mol×K 485.77 Joback Calculated Property
Cp,gas 318.93 J/mol×K 516.03 Joback Calculated Property
Cp,gas 331.30 J/mol×K 546.29 Joback Calculated Property
Cp,gas 343.15 J/mol×K 576.54 Joback Calculated Property
Cp,gas 354.47 J/mol×K 606.80 Joback Calculated Property
Cp,gas 365.29 J/mol×K 637.06 Joback Calculated Property
Cp,gas 375.62 J/mol×K 667.32 Joback Calculated Property
η [0.0002011; 0.0030655] Pa×s [258.27; 485.77] Show Hide
η 0.0030655 Pa×s 258.27 Joback Calculated Property
η 0.0014558 Pa×s 296.19 Joback Calculated Property
η 0.0008186 Pa×s 334.10 Joback Calculated Property
η 0.0005177 Pa×s 372.02 Joback Calculated Property
η 0.0003563 Pa×s 409.94 Joback Calculated Property
η 0.0002612 Pa×s 447.85 Joback Calculated Property
η 0.0002011 Pa×s 485.77 Joback Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Pvap [1.33; 202.64] kPa [354.34; 489.46] The Yaw... Show Hide
Equationln(Pvp) = A + B/(T + C)
Coefficient A1.58377e+01
Coefficient B-4.40236e+03
Coefficient C-7.12340e+01
Temperature range, min.354.34
Temperature range, max.489.46
Pvap 1.33 kPa 354.34 Calculated Property
Pvap 2.92 kPa 369.35 Calculated Property
Pvap 5.92 kPa 384.37 Calculated Property
Pvap 11.27 kPa 399.38 Calculated Property
Pvap 20.26 kPa 414.39 Calculated Property
Pvap 34.69 kPa 429.41 Calculated Property
Pvap 56.88 kPa 444.42 Calculated Property
Pvap 89.77 kPa 459.43 Calculated Property
Pvap 136.93 kPa 474.45 Calculated Property
Pvap 202.64 kPa 489.46 Calculated Property

Similar Compounds

(Z)-2-Hexenyl propanoate. 2E-hexenyl-d3 proprionate. Succinic acid, di(cis-hex-2-en-1-yl) ester. Butanoic acid, 2-hexenyl ester, (E)-. 2-Hexenyl butanoate, isomer # 1. (Z)-2-Hexenyl butyrate. 2E-hexenyl-d3 butanoate-d3. 2E-hexenyl-d3 butanoate. 2-Hexenyl butanoate, isomer # 2. (E)-2-Hexenyl isobutyrate. (Z)-3-Hexenyl isobutyrate. 2-Hexen-1-ol, acetate, (E)-. 2-Hexen-1-ol, acetate, (Z)-. 2E-hexenyl-d3 acetate. 2-Hexen-1-ol, acetate.

Find more compounds similar to 2-Hexen-1-ol, propanoate, (E)-.

Sources

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