1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate
TL;DR: 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate (CAS 148832-07-9) is a chemical compound with molecular formula C29H36O15 and molecular weight 624.20544 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-bis[[(2R,3S,4R,5R)-2,4,5,6-tetrahydroxy-1-oxohexan-3-yl]oxy]propan-2-yl 4-benzoylbenzoate
Also Known As: B3GL, 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate, 1,3-bis[[(2R,3S,4R,5R)-2,4,5,6-tetrahydroxy-1-oxohexan-3-yl]oxy]propan-2-yl 4-benzoylbenzoate, D-Glucose,3,3'-O-[2-[(4-benzoylbenzoyl)oxy]-1,3-propanediyl]bis- (9CI)
Technical Specifications
| Molecular Formula | C29H36O15 |
| Molecular Weight | 624.20544 g/mol |
| XLogP | -3.1 |
| Topological Polar Surface Area (TPSA) | 258.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 21 |
| Exact Mass | 624.20544 Da |
| Heavy Atoms | 44 |
| Complexity | 835.0 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)C(=O)OC(CO[C@H]([C@H](C=O)O)[C@@H]([C@@H](CO)O)O)CO[C@H]([C@H](C=O)O)[C@@H]([C@@H](CO)O)O |
| InChIKey | KKWJEBGSYUNAIH-HPLLXZBVSA-N |
Chemical Property Profile of 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate
Property Insights of 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate
The XLogP value of -3.1 indicates that 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 258.0 Ų indicates high polarity, suggesting 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate has 8 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate?
The CAS number of 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate is 148832-07-9.
What is the molecular formula of 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate?
The molecular formula of 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate is C29H36O15.
What is the molecular weight of 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate?
The molecular weight of 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate is 624.20544 g/mol.
Where can I buy 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate?
You can request a quote for 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate?
Yes, CoreyChem provides custom synthesis services for 1,3-Bis(3-deoxyglucopyranose-3-yloxy)-2-propyl-4-benzoylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.