Chemical Properties of Benzaldehyde, 2-hydroxy, 5-hexyl

Benzaldehyde, 2-hydroxy, 5-hexyl

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InChI
InChI=1S/C13H18O2/c1-2-3-4-5-6-11-7-8-13(15)12(9-11)10-14/h7-10,15H,2-6H2,1H3
InChI Key
AKLLVPQDWXRGLG-UHFFFAOYSA-N
Formula
C13H18O2
SMILES
CCCCCCc1ccc(O)c(C=O)c1
Molecular Weight1
206.28
Sources

Physical Properties

Property Value Unit Source
Δf -92.78 kJ/mol Joback Calculated Property
Δfgas -349.48 kJ/mol Joback Calculated Property
Δfus 31.15 kJ/mol Joback Calculated Property
Δvap 67.20 kJ/mol Joback Calculated Property
logPoct/wat 3.33 Crippen Calculated Property
Pc 2693.00 kPa Joback Calculated Property
Tboil 657.78 K Joback Calculated Property
Tc 868.90 K Joback Calculated Property
Tfus 428.93 K Joback Calculated Property
Vc 0.64 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 472.92 J/mol×K 657.78 Joback Calculated Property
η 0.00 Pa×s 657.78 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
=CH- (ring) 3
=C< (ring) 3
-CH2- 5
O=CH- (aldehyde) 1
-CH3 1
-OH (phenol) 1

Similar Compounds

Benzaldehyde, 2-hydroxy, 5-octyl. Benzaldehyde, 2-hydroxy, 5-dodecyl. Benzaldehyde, 2-hydroxy, 5-butyl. 5-Sec-butyl-2-hydroxybenzaldehyde. Benzaldehyde, 2-hydroxy, 5-ethyl. Benzaldehyde, 2-hydroxy, 5-(t-butyl). Benzaldehyde, 2-hydroxy, 5-(1,1,3,3-tetramethylbutyl). O-cresol, 4-(1-methylhexyl)-. 2,4-Dinonylphenol. 2-Methyl-4-propylphenol. P-cresol, 2,2'-decamethylenedi-. Ethanone, 1-(2-hydroxy-5-methylphenyl)-. 4-Hydroxy-3-methylacetophenone. 2,4-Dibutylphenol. 2-Butyl-4-methyl phenol.

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