Chemical Properties of Benzoic acid, 2-chloro, (E)-3-hexenyl ester

Benzoic acid, 2-chloro, (E)-3-hexenyl ester

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InChI
InChI=1S/C13H15ClO2/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h3-6,8-9H,2,7,10H2,1H3/b4-3+
InChI Key
QKLADRCZQCRRDB-ONEGZZNKSA-N
Formula
C13H15ClO2
SMILES
CCC=CCCOC(=O)c1ccccc1Cl
Molecular Weight1
238.71
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Physical Properties

Property Value Unit Source
Δf -4.27 kJ/mol Joback Calculated Property
Δfgas -229.91 kJ/mol Joback Calculated Property
Δfus 30.26 kJ/mol Joback Calculated Property
Δvap 60.97 kJ/mol Joback Calculated Property
log10WS -4.35 Crippen Calculated Property
logPoct/wat 3.853 Crippen Calculated Property
McVol 185.650 ml/mol McGowan Calculated Property
Pc 2291.52 kPa Joback Calculated Property
Inp [1696.00; 1721.00]   Show Hide
Inp 1696.00 NIST
Inp 1707.00 NIST
Inp 1715.00 NIST
Inp 1721.00 NIST
Inp 1703.00 NIST
Inp 1714.00 NIST
Inp 1696.00 NIST
I [2351.00; 2414.00]   Show Hide
I 2351.00 NIST
I 2371.00 NIST
I 2392.00 NIST
I 2414.00 NIST
I 2384.00 NIST
I 2397.00 NIST
Tboil 646.38 K Joback Calculated Property
Tc 862.28 K Joback Calculated Property
Tfus 372.21 K Joback Calculated Property
Vc 0.709 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [449.70; 521.47] J/mol×K [646.38; 862.28] Show Hide
Cp,gas 449.70 J/mol×K 646.38 Joback Calculated Property
Cp,gas 463.75 J/mol×K 682.36 Joback Calculated Property
Cp,gas 476.91 J/mol×K 718.35 Joback Calculated Property
Cp,gas 489.23 J/mol×K 754.33 Joback Calculated Property
Cp,gas 500.74 J/mol×K 790.31 Joback Calculated Property
Cp,gas 511.47 J/mol×K 826.29 Joback Calculated Property
Cp,gas 521.47 J/mol×K 862.28 Joback Calculated Property
η [0.0001342; 0.0013603] Pa×s [372.21; 646.38] Show Hide
η 0.0013603 Pa×s 372.21 Joback Calculated Property
η 0.0007487 Pa×s 417.91 Joback Calculated Property
η 0.0004636 Pa×s 463.60 Joback Calculated Property
η 0.0003128 Pa×s 509.30 Joback Calculated Property
η 0.0002252 Pa×s 554.99 Joback Calculated Property
η 0.0001705 Pa×s 600.68 Joback Calculated Property
η 0.0001342 Pa×s 646.38 Joback Calculated Property

Similar Compounds

Benzoic acid, 2-chloro, (Z)-3-hexenyl ester. (Z)-Hex-3-enyl 3-chlorobenzoate. (E)-Hex-3-enyl 3-chlorobenzoate. Benzoic acid, 2-chloro, 3-butenyl ester. Benzoic acid, 4-chloro, (Z)-3-hexenyl ester. Benzoic acid, 4-chloro, (E)-3-hexenyl ester. 3-Hexen-1-ol, benzoate, (Z)-. 3-Hexen-1-ol benzoate. Hex-3-enyl benzoate. (Z)-Non-3-enyl 3-chlorobenzoate. Benzoic acid, 2-chloro, propyl ester. Isophthalic acid, di(cis-hex-3-enyl) ester. Isophthalic acid, di(trans-hex-3-enyl) ester. Di(Z)-hex-3-enyl phthalate. Di(E)-hex-3-enyl phthalate.

Find more compounds similar to Benzoic acid, 2-chloro, (E)-3-hexenyl ester.

Sources

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