Chemical Properties of Retinyl octanoate

Retinyl octanoate

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InChI
InChI=1S/C28H44O2/c1-7-8-9-10-11-17-27(29)30-22-20-24(3)15-12-14-23(2)18-19-26-25(4)16-13-21-28(26,5)6/h12,14-15,18-20H,7-11,13,16-17,21-22H2,1-6H3/b15-12+,19-18+,23-14+,24-20+
InChI Key
AWGMQQGZWRIUJI-UBMBPVGBSA-N
Formula
C28H44O2
SMILES
CCCCCCCC(=O)OCC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C
Molecular Weight1
412.65
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Physical Properties

Property Value Unit Source
Δf 284.40 kJ/mol Joback Calculated Property
Δfgas -312.35 kJ/mol Joback Calculated Property
Δfus 55.23 kJ/mol Joback Calculated Property
Δvap 87.96 kJ/mol Joback Calculated Property
log10WS -9.33 Crippen Calculated Property
logPoct/wat 8.422 Crippen Calculated Property
McVol 380.460 ml/mol McGowan Calculated Property
Pc 872.22 kPa Joback Calculated Property
Inp [3157.00; 3157.00]   Show Hide
Inp 3157.00 NIST
Inp 3157.00 NIST
Tboil 961.64 K Joback Calculated Property
Tc 1180.54 K Joback Calculated Property
Tfus 486.32 K Joback Calculated Property
Vc 1.466 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1277.41; 1429.15] J/mol×K [961.64; 1180.54] Show Hide
Cp,gas 1277.41 J/mol×K 961.64 Joback Calculated Property
Cp,gas 1302.27 J/mol×K 998.12 Joback Calculated Property
Cp,gas 1327.03 J/mol×K 1034.61 Joback Calculated Property
Cp,gas 1351.89 J/mol×K 1071.09 Joback Calculated Property
Cp,gas 1377.06 J/mol×K 1107.57 Joback Calculated Property
Cp,gas 1402.74 J/mol×K 1144.05 Joback Calculated Property
Cp,gas 1429.15 J/mol×K 1180.54 Joback Calculated Property

Similar Compounds

Retinol, hexadecanoate, 11-cis-. Vitamin A palmitate. Retinyl decanoate. Retinyl dodecanoate. Retinyl hexanoate. Retinyl butanoate. Retinol, acetate. Retinoic acid, methyl ester. Retinol. Methyl-Labd-8-enoate. Methyl chol-4,6-dien-3-one-24-oate, oxime, TMS. 3-oxy-4,6-cholenoate, methyl ester-trimethylsilyl ether. 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,10,10a-decahydro-1,4a-dimethyl-7-(1-methylethenyl)-, methyl ester, [1R-(1«alpha»,4a«beta»,4b«alpha»,10a«alpha»)]-. 4,6-Choladienoic acid, 12-«alpha»-hydroxy-3-one, methyl ester, TMS. Prednisolone Acetate.

Find more compounds similar to Retinyl octanoate.

Sources

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