Cas no 94902-60-0 (Methyl 2,3-DI-O-benzyl-4,6-O-(4-methoxybenzylidene)-A-D-glucopyranoside)
94902-60-0 structure
Product Name:Methyl 2,3-DI-O-benzyl-4,6-O-(4-methoxybenzylidene)-A-D-glucopyranoside
CAS No:94902-60-0
MF:C29H32O7
MW:492.560189247131
CID:799019
Update Time:2023-08-03
Methyl 2,3-DI-O-benzyl-4,6-O-(4-methoxybenzylidene)-A-D-glucopyranoside Chemical and Physical Properties
Names and Identifiers
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- a-D-Glucopyranoside, methyl4,6-O-[(4-methoxyphenyl)methylene]-2,3-bis-O-(phenylmethyl)-
- methyl 2,3-di-O-benzyl-4,6-O-(4-methoxybenzylidene)-α-D-glucopyranoside
- METHYL-4,6-DI-O-(4-METHOXYBENZYLIDENE)-2,3-DI-O-BENZYL-Α-GLUCOPYRANOSIDE
- METHYL 2,3-DI-O-BENZYL-4,6-O-(4-METHOXYBENZYLIDENE)-A-D-GLUCOPYRANOSIDE
- Methyl 2-O,3-O-dibenzyl-4-O,6-O-(4-methoxybenzylidene)-alpha-D-glucopyranoside
- Methyl 2,3-DI-O-benzyl-4,6-O-(4-methoxybenzylidene)-A-D-glucopyranoside
-
- Inchi： 1S/C29H32O7/c1-30-23-15-13-22(14-16-23)28-34-19-24-25(36-28)26(32-17-20-9-5-3-6-10-20)27(29(31-2)35-24)33-18-21-11-7-4-8-12-21/h3-16,24-29H,17-19H2,1-2H3/t24-,25-,26+,27-,28?,29+/m1/s1
- InChI Key： DHAREFMCLBQPOA-ICHYBAGLSA-N
- SMILES： O1[C@@H]([C@@H]([C@H]([C@H]2[C@H]1COC(C1C=CC(=CC=1)OC)O2)OCC1C=CC=CC=1)OCC1C=CC=CC=1)OC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 36
- Rotatable Bond Count: 9
- Complexity: 627
- Topological Polar Surface Area: 64.599
Experimental Properties
- Density: 1.24±0.1 g/cm3 (20 oC 760 Torr),
- Solubility: Almost insoluble (0.025 g/l) (25 o C),
Methyl 2,3-DI-O-benzyl-4,6-O-(4-methoxybenzylidene)-A-D-glucopyranoside Related Literature
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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4. 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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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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