Chemical Properties of Retinyl dodecanoate

Retinyl dodecanoate

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InChI
InChI=1S/C32H52O2/c1-7-8-9-10-11-12-13-14-15-21-31(33)34-26-24-28(3)19-16-18-27(2)22-23-30-29(4)20-17-25-32(30,5)6/h16,18-19,22-24H,7-15,17,20-21,25-26H2,1-6H3/b19-16+,23-22+,27-18+,28-24+
InChI Key
ZGISOPBIAXHOTQ-OUGXGHBNSA-N
Formula
C32H52O2
SMILES
CCCCCCCCCCCC(=O)OCC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C
Molecular Weight1
468.75
Sources

Physical Properties

Property Value Unit Source
Δf 318.08 kJ/mol Joback Calculated Property
Δfgas -394.91 kJ/mol Joback Calculated Property
Δfus 65.59 kJ/mol Joback Calculated Property
Δvap 96.87 kJ/mol Joback Calculated Property
logPoct/wat 9.982 Crippen Calculated Property
Pc 703.59 kPa Joback Calculated Property
Tboil 1053.16 K Joback Calculated Property
Tc 1290.64 K Joback Calculated Property
Tfus 531.40 K Joback Calculated Property
Vc 1.690 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1550.46 J/mol×K 1053.16 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
=C< 2
>C=O (nonring) 1
=C< (ring) 2
-CH2- 11
=CH- 6
>C< (ring) 1
-CH3 6
-CH2- (ring) 3

Similar Compounds

Retinyl octanoate. Retinyl decanoate. Vitamin A palmitate. Retinol, hexadecanoate, 11-cis-. Retinyl hexanoate. Retinyl butanoate. Retinol, acetate. Retinoic acid, methyl ester. Retinol. .beta.,.beta.-Carotene. Retinal. Retinal, 9-cis-. .beta.-Ionyl acetate. B-Ionene. Methyl-Labd-8-enoate.

Find more compounds similar to Retinyl dodecanoate.

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