Benzaldehyde, 4-(beta-D-allopyranosyloxy)-
TL;DR: Benzaldehyde, 4-(beta-D-allopyranosyloxy)- (CAS 80154-34-3) is a chemical compound with molecular formula C13H16O7 and molecular weight 284.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzaldehyde
Also Known As: Helicide, Helicid, Benzaldehyde, 4-(beta-D-allopyranosyloxy)-, 2-Formylphenyl beta-L-glucopyranoside, 2-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzaldehyde
| Molecular Formula | C13H16O7 |
|---|---|
| Molecular Weight | 284.09 g/mol |
| LogP | -1.3222 |
| Topological Polar Surface Area | 116.45 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.0896 |
| Heavy Atoms | 20 |
| Complexity | 461.7878 |
Chemical Identifiers
| CAS Number | 80154-34-3 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=O)O[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)CO)O)O)O |
Product Overview
Benzaldehyde, 4-(beta-D-allopyranosyloxy)- (CAS 80154-34-3), with molecular formula C13H16O7 and molecular weight 284.09 g/mol. IUPAC: 2-[(2R,3S,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzaldehyde.
Chemical Property Profile of Benzaldehyde, 4-(beta-D-allopyranosyloxy)-
Property Insights of Benzaldehyde, 4-(beta-D-allopyranosyloxy)-
The XLogP value of -1.3222 indicates that Benzaldehyde, 4-(beta-D-allopyranosyloxy)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 116.45 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzaldehyde, 4-(beta-D-allopyranosyloxy)-. Following Lipinski's Rule of Five, Benzaldehyde, 4-(beta-D-allopyranosyloxy)- has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzaldehyde, 4-(beta-D-allopyranosyloxy)-?
The CAS number of Benzaldehyde, 4-(beta-D-allopyranosyloxy)- is 80154-34-3.
What is the molecular formula of Benzaldehyde, 4-(beta-D-allopyranosyloxy)-?
The molecular formula of Benzaldehyde, 4-(beta-D-allopyranosyloxy)- is C13H16O7.
What is the molecular weight of Benzaldehyde, 4-(beta-D-allopyranosyloxy)-?
The molecular weight of Benzaldehyde, 4-(beta-D-allopyranosyloxy)- is 284.09 g/mol.
Where can I buy Benzaldehyde, 4-(beta-D-allopyranosyloxy)-?
You can request a quote for Benzaldehyde, 4-(beta-D-allopyranosyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzaldehyde, 4-(beta-D-allopyranosyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzaldehyde, 4-(beta-D-allopyranosyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.