| CAS Number | 1105054-66-7 |
| Catalog Number | AG00HBQF(AGN-PC-0WR0F7) |
| Chemical Name | 2,3,5-Tri-o-benzyl-beta-d-xylofuranose |
| IUPAC Name | (2R,3R,4S,5R)-3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-ol |
| InChI | InChI=1S/C26H28O5/c27-26-25(30-18-22-14-8-3-9-15-22)24(29-17-21-12-6-2-7-13-21)23(31-26)19-28-16-20-10-4-1-5-11-20/h1-15,23-27H,16-19H2/t23-,24+,25-,26-/m1/s1 |
| InChI Key | NAQUAXSCBJPECG-XDZVQPMWSA-N |
| MDL Number | MFCD09864638 |
| Molecular Formula | C26H28O5 |
| Molecular Weight | 420.4975 |
| SMILES | O[C@@H]1O[C@@H]([C@@H]([C@H]1OCc1ccccc1)OCc1ccccc1)COCc1ccccc1 |
| Synonyms | 2,3,5-TRI-O-BENZYL-BETA-D-XYLOFURANOSE,
1105054-66-7,
(2R,3R,4S,5R)-3,4-Bis(benzyloxy)-5-((benzyloxy)methyl)tetrahydrofuran-2-ol,
KM5473,
ZINC22067189,
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| Complexity | 482 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 4 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 420.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 31 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 420.505g/mol |
| Monoisotopic Mass | 420.194g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 57.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
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Certificate of Analysis
Lot Number