Chemical Properties of 3-Hexen-1-ol benzoate

3-Hexen-1-ol 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/h3-7,9-10H,2,8,11H2,1H3/b4-3-
InChI Key
BCOXBEHFBZOJJZ-ARJAWSKDSA-N
Formula
C13H16O2
SMILES
CCC=CCCOC(=O)c1ccccc1
Molecular Weight1
204.26
Other Names
  • (E)-3-Hexenyl 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 [1535.00; 1585.00]   Show Hide
Inp 1540.00 NIST
Inp 1536.00 NIST
Inp 1553.00 NIST
Inp 1536.00 NIST
Inp 1544.00 NIST
Inp 1549.00 NIST
Inp 1546.00 NIST
Inp 1535.00 NIST
Inp 1545.00 NIST
Inp 1540.00 NIST
Inp Outlier 1585.00 NIST
Inp 1553.00 NIST
Inp 1541.00 NIST
Inp 1540.00 NIST
Inp 1549.00 NIST
I [2046.00; 2120.00]   Show Hide
I 2089.00 NIST
I 2083.00 NIST
I 2100.00 NIST
I 2115.00 NIST
I 2046.00 NIST
I 2051.00 NIST
I 2069.00 NIST
I 2120.00 NIST
I 2088.00 NIST
I 2095.00 NIST
I 2101.00 NIST
I 2069.00 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

Hex-3-enyl benzoate. 3-Hexen-1-ol, benzoate, (Z)-. Isophthalic acid, di(cis-hex-3-enyl) ester. Isophthalic acid, di(trans-hex-3-enyl) ester. Isophthalic acid, cis-hex-3-enyl propyl ester. Benzoic acid, 4-chloro, (Z)-3-hexenyl ester. Benzoic acid, 4-chloro, (E)-3-hexenyl ester. Di(E)-hex-3-enyl phthalate. Di(Z)-hex-3-enyl phthalate. Phthalic acid, cis-hex-3-enyl ethyl ester. Phthalic acid, ethyl trans-hex-3-enyl ester. Phthalic acid, cis-hex-3-enyl propyl ester. Phthalic acid, propyl trans-hex-3-enyl ester. Isophthalic acid, isobutyl trans-hex-3-enyl ester. Isophthalic acid, cis-hex-3-enyl isobutyl ester.

Find more compounds similar to 3-Hexen-1-ol benzoate.

Sources

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