Chemical Properties of Retinol, acetate (CAS 127-47-9)

Retinol, acetate

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InChI
InChI=1S/C22H32O2/c1-17(9-7-10-18(2)14-16-24-20(4)23)12-13-21-19(3)11-8-15-22(21,5)6/h7,9-10,12-14H,8,11,15-16H2,1-6H3/b10-7+,13-12+,17-9+,18-14+
InChI Key
QGNJRVVDBSJHIZ-QHLGVNSISA-N
Formula
C22H32O2
SMILES
CC(=O)OCC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C
Molecular Weight1
328.49
CAS
127-47-9
Other Names
  • Retinol, acetate, all-trans-
  • all-trans-Retinol acetate
  • all-trans-Retinyl acetate
  • all-trans-Vitamin A acetate
  • trans-Retinyl acetate
  • Myvak
  • Myvax
  • Retinyl acetate
  • Vitamin A acetate
  • Vitamin A1 acetate
  • trans-Vitamin A acetate
  • Crystalets
  • Davitan A 650
  • Vitamin A alcohol acetate
  • 3,7-Dimethyl-9-(2,6,6,-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraen-1-ol acetate, (all trans)-
  • NSC 122045
  • Ro 1-5275
  • trans-Retinol acetate

Physical Properties

Property Value Unit Source
Δcsolid -11517.70 ± 6.00 kJ/mol NIST
Δf 233.88 kJ/mol Joback Calculated Property
Δfgas -188.51 kJ/mol Joback Calculated Property
Δfsolid -1713.00 ± 6.00 kJ/mol NIST
Δfus 39.69 kJ/mol Joback Calculated Property
Δvap 74.61 kJ/mol Joback Calculated Property
log10WS -6.82 Crippen Calculated Property
logPoct/wat 6.081 Crippen Calculated Property
McVol 295.920 ml/mol McGowan Calculated Property
Pc 1266.45 kPa Joback Calculated Property
Inp [2531.00; 2578.00]   Show Hide
Inp 2578.00 NIST
Inp 2531.00 NIST
Inp 2578.00 NIST
Inp 2531.00 NIST
Tboil 824.36 K Joback Calculated Property
Tc 1042.16 K Joback Calculated Property
Tfus 418.70 K Joback Calculated Property
Vc 1.131 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [896.69; 1017.27] J/mol×K [824.36; 1042.16] Show Hide
Cp,gas 896.69 J/mol×K 824.36 Joback Calculated Property
Cp,gas 917.44 J/mol×K 860.66 Joback Calculated Property
Cp,gas 937.68 J/mol×K 896.96 Joback Calculated Property
Cp,gas 957.60 J/mol×K 933.26 Joback Calculated Property
Cp,gas 977.38 J/mol×K 969.56 Joback Calculated Property
Cp,gas 997.21 J/mol×K 1005.86 Joback Calculated Property
Cp,gas 1017.27 J/mol×K 1042.16 Joback Calculated Property

Similar Compounds

Retinyl butanoate. Retinoic acid, methyl ester. Vitamin A palmitate. Retinyl octanoate. Retinol, hexadecanoate, 11-cis-. Retinyl dodecanoate. Retinyl decanoate. Retinyl hexanoate. Retinol. Retinal. Retinal, 9-cis-. «beta» Carotene. «beta»-Ionyl acetate. Anhydroretinol. B-Ionene.

Find more compounds similar to Retinol, acetate.

Sources

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