Chemical Properties of Retinyl hexanoate

Retinyl hexanoate

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InChI
InChI=1S/C26H40O2/c1-7-8-9-15-25(27)28-20-18-22(3)13-10-12-21(2)16-17-24-23(4)14-11-19-26(24,5)6/h10,12-13,16-18H,7-9,11,14-15,19-20H2,1-6H3/b13-10+,17-16+,21-12+,22-18+
InChI Key
JOHZSPKDCASWAX-BAJOQGENSA-N
Formula
C26H40O2
SMILES
CCCCCC(=O)OCC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C
Molecular Weight1
384.59
Sources

Physical Properties

Property Value Unit Source
Δf 267.56 kJ/mol Joback Calculated Property
Δfgas -271.07 kJ/mol Joback Calculated Property
Δfus 50.05 kJ/mol Joback Calculated Property
Δvap 83.51 kJ/mol Joback Calculated Property
logPoct/wat 7.642 Crippen Calculated Property
Pc 980.23 kPa Joback Calculated Property
Tboil 915.88 K Joback Calculated Property
Tc 1131.30 K Joback Calculated Property
Tfus 463.78 K Joback Calculated Property
Vc 1.355 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1146.53 J/mol×K 915.88 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-CH3 6
=C< (ring) 2
-CH2- 5
=C< 2
=CH- 6
>C< (ring) 1
>C=O (nonring) 1
-CH2- (ring) 3

Similar Compounds

Retinyl decanoate. Retinyl dodecanoate. Vitamin A palmitate. Retinyl octanoate. Retinol, hexadecanoate, 11-cis-. Retinyl butanoate. Retinol, acetate. Retinoic acid, methyl ester. Retinol. .beta.,.beta.-Carotene. Retinal, 9-cis-. Retinal. .beta.-Ionyl acetate. B-Ionene. 3-Buten-2-ol, 4-(2,6,6-trimethyl-1-cyclohexen-1-yl)-.

Find more compounds similar to Retinyl hexanoate.

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