Chemical Properties of n-Hexyl salicylate (CAS 6259-76-3)

n-Hexyl salicylate

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InChI
InChI=1S/C13H18O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h5-6,8-9,14H,2-4,7,10H2,1H3
InChI Key
DUKPKQFHJQGTGU-UHFFFAOYSA-N
Formula
C13H18O3
SMILES
CCCCCCOC(=O)c1ccccc1O
Molecular Weight1
222.28
CAS
6259-76-3
Other Names
  • Benzoic acid, 2-hydroxy-, hexyl ester
  • Hexyl salicylate
  • Salicylic acid, hexyl ester
  • Hexyl 2-hydroxybenzoate
  • Hexyl salicilate
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Physical Properties

Property Value Unit Source
Δf -217.55 kJ/mol Joback Calculated Property
Δfgas -497.23 kJ/mol Joback Calculated Property
Δfus 32.04 kJ/mol Joback Calculated Property
Δvap 68.98 kJ/mol Joback Calculated Property
log10WS -3.36 Crippen Calculated Property
logPoct/wat 3.129 Crippen Calculated Property
McVol 183.580 ml/mol McGowan Calculated Property
Pc 2657.03 kPa Joback Calculated Property
Inp [1639.00; 1684.00]   Show Hide
Inp 1652.00 NIST
Inp 1651.50 NIST
Inp 1684.00 NIST
Inp 1683.00 NIST
Inp 1682.10 NIST
Inp 1656.00 NIST
Inp 1639.00 NIST
Inp 1664.00 NIST
I [2171.00; 2229.00]   Show Hide
I 2171.00 NIST
I 2203.00 NIST
I 2208.00 NIST
I 2206.00 NIST
I 2175.00 NIST
I 2221.00 NIST
I 2208.00 NIST
I 2229.00 NIST
I 2208.00 NIST
Tboil 680.43 K Joback Calculated Property
Tc 892.73 K Joback Calculated Property
Tfus 446.57 K Joback Calculated Property
Vc 0.645 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [499.06; 572.26] J/mol×K [680.43; 892.73] Show Hide
Cp,gas 499.06 J/mol×K 680.43 Joback Calculated Property
Cp,gas 513.11 J/mol×K 715.81 Joback Calculated Property
Cp,gas 526.34 J/mol×K 751.20 Joback Calculated Property
Cp,gas 538.80 J/mol×K 786.58 Joback Calculated Property
Cp,gas 550.57 J/mol×K 821.96 Joback Calculated Property
Cp,gas 561.70 J/mol×K 857.35 Joback Calculated Property
Cp,gas 572.26 J/mol×K 892.73 Joback Calculated Property
η [0.0000166; 0.0005088] Pa×s [446.57; 680.43] Show Hide
η 0.0005088 Pa×s 446.57 Joback Calculated Property
η 0.0002287 Pa×s 485.55 Joback Calculated Property
η 0.0001158 Pa×s 524.52 Joback Calculated Property
η 0.0000644 Pa×s 563.50 Joback Calculated Property
η 0.0000386 Pa×s 602.48 Joback Calculated Property
η 0.0000247 Pa×s 641.45 Joback Calculated Property
η 0.0000166 Pa×s 680.43 Joback Calculated Property

Similar Compounds

Benzoic acid, 2-hydroxy-, heptyl ester. Salicylic acid, n-octyl ester. Benzoic acid, 2-hydroxy-, pentyl ester. Benzoic acid, 2-hydroxy-, butyl ester. Isoamyl salicylate. 2-Ethylhexyl salicylate. Hexyl 2-phenoxybenzoate. o-Methoxybenzoic acid, octadecyl ester. o-Methoxybenzoic acid, heptyl ester. o-Anisic acid, nonyl ester. o-Anisic acid, undecyl ester. o-Anisic acid, heptadecyl ester. o-Methoxybenzoic acid, pentadecyl ester. o-Methoxybenzoic acid, hexadecyl ester. o-Methoxybenzoic acid, tridecyl ester.

Find more compounds similar to n-Hexyl salicylate.

Sources

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