Chemical Properties of E-2-Hexenyl benzoate (CAS 76841-70-8)

E-2-Hexenyl benzoate

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InChI
InChI=1S/C13H16O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h4-10H,2-3,11H2,1H3/b8-4+
InChI Key
IRWNFSMZBFIURE-XBXARRHUSA-N
Formula
C13H16O2
SMILES
CCCC=CCOC(=O)c1ccccc1
Molecular Weight1
204.26
CAS
76841-70-8
Other Names
  • (2E)-2-Hexenyl benzoate
  • 2-Hexen-1-ol, benzoate, trans
  • (E)-2-Hexen-1-ol, benzoate
  • (E)-2-Hexen-1-yl-benzoate
  • trans-2-Hexenyl benzoate
  • 3-Hexen-1-ol, benzoate, trans
  • (E)-3-Hexen-1-yl-benzoate
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Physical Properties

Property Value Unit Source
Δf 17.29 kJ/mol Joback Calculated Property
Δfgas -202.70 kJ/mol Joback Calculated Property
Δfus 26.46 kJ/mol Joback Calculated Property
Δvap 55.92 kJ/mol Joback Calculated Property
log10WS -3.66 Crippen Calculated Property
logPoct/wat 3.200 Crippen Calculated Property
McVol 173.410 ml/mol McGowan Calculated Property
Pc 2410.00 kPa Joback Calculated Property
Inp [1534.00; 1590.70]   Show Hide
Inp 1583.00 NIST
Inp 1590.70 NIST
Inp 1588.00 NIST
Inp 1556.00 NIST
Inp 1584.00 NIST
Inp Outlier 1534.00 NIST
Inp 1553.00 NIST
Inp 1588.00 NIST
Inp 1587.00 NIST
I [2081.00; 2127.00]   Show Hide
I 2127.00 NIST
I 2081.00 NIST
I 2104.00 NIST
I 2127.00 NIST
Tboil 603.97 K Joback Calculated Property
Tc 815.36 K Joback Calculated Property
Tfus 329.77 K Joback Calculated Property
Vc 0.659 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [423.08; 501.68] J/mol×K [603.97; 815.36] Show Hide
Cp,gas 423.08 J/mol×K 603.97 Joback Calculated Property
Cp,gas 438.38 J/mol×K 639.20 Joback Calculated Property
Cp,gas 452.75 J/mol×K 674.43 Joback Calculated Property
Cp,gas 466.22 J/mol×K 709.66 Joback Calculated Property
Cp,gas 478.84 J/mol×K 744.90 Joback Calculated Property
Cp,gas 490.65 J/mol×K 780.13 Joback Calculated Property
Cp,gas 501.68 J/mol×K 815.36 Joback Calculated Property
η [0.0001434; 0.0019948] Pa×s [329.77; 603.97] Show Hide
η 0.0019948 Pa×s 329.77 Joback Calculated Property
η 0.0009848 Pa×s 375.47 Joback Calculated Property
η 0.0005667 Pa×s 421.17 Joback Calculated Property
η 0.0003633 Pa×s 466.87 Joback Calculated Property
η 0.0002522 Pa×s 512.57 Joback Calculated Property
η 0.0001858 Pa×s 558.27 Joback Calculated Property
η 0.0001434 Pa×s 603.97 Joback Calculated Property

Similar Compounds

Pent-2-en-1-yl benzoate. Isophthalic acid, di(undec-2-en-1-yl) ester. 4-Cyanobenzoic acid, undec-2-enyl ester. Isophthalic acid, ethyl undec-2-en-1-yl ester. p-Toluic acid, undec-2-enyl ester. 4-Bromobenzoic acid, undec-2-enyl ester. 4-Chlorobenzoic acid, undec-2-enyl ester. 4-Fluorobenzoic acid, undec-2-enyl ester. 4-(Trifluoromethyl)benzoic acid, undec-2-enyl ester. Terephthalic acid, dodec-2-enyl isobutyl ester. (E)-Dodec-2-enyl 3-chlorobenzoate. 1-Naphthoic acid, undec-2-enyl ester. Isophthalic acid, propyl undec-2-en-1-yl ester. 3-Bromobenzoic acid, undec-2-enyl ester. 3-Fluorobenzoic acid, undec-2-enyl ester.

Find more compounds similar to E-2-Hexenyl benzoate.

Sources

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