Cas no 53254-77-6 (3,5-Tetradecanediol,1-(4-hydroxy-3-methoxyphenyl)-, (3R,5S)-)
53254-77-6 structure
Product Name:3,5-Tetradecanediol,1-(4-hydroxy-3-methoxyphenyl)-, (3R,5S)-
CAS No:53254-77-6
MF:C21H36O4
MW:352.508147239685
CID:382551
Update Time:2024-03-02
3,5-Tetradecanediol,1-(4-hydroxy-3-methoxyphenyl)-, (3R,5S)- Chemical and Physical Properties
Names and Identifiers
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- 3,5-Tetradecanediol,1-(4-hydroxy-3-methoxyphenyl)-, (3R,5S)-
- [10]-Gingediol
- [10]-Gingerdiol
- 3,5-Tetradecanediol, 1-(4-hydroxy-3-methoxyphenyl)-, (3R,5S)-
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- Inchi： 1S/C21H36O4/c1-3-4-5-6-7-8-9-10-18(22)16-19(23)13-11-17-12-14-20(24)21(15-17)25-2/h12,14-15,18-19,22-24H,3-11,13,16H2,1-2H3/t18-,19+/m0/s1
- InChI Key： LGSIUDXMEDKEPY-RBUKOAKNSA-N
- SMILES： C(C1=CC=C(O)C(OC)=C1)C[C@@H](O)C[C@@H](O)CCCCCCCCC
Computed Properties
- Exact Mass: 352.26148
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 25
- XLogP3: 4.854
Experimental Properties
- Density: 1.041±0.06 g/cm3(Predicted)
- Boiling Point: 518.0±45.0 °C(Predicted)
- PSA: 69.92
- pka: 10.14±0.20(Predicted)
3,5-Tetradecanediol,1-(4-hydroxy-3-methoxyphenyl)-, (3R,5S)- Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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