3,4-Dinitrophenyl-beta-galactopyranoside
TL;DR: 3,4-Dinitrophenyl-beta-galactopyranoside (CAS 85668-54-8) is a chemical compound with molecular formula C12H14N2O10 and molecular weight 346.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,4S,5R,6R)-2-(3,4-dinitrophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
Also Known As: 3,4-Dnp-gal, 3,4-Dinitrophenyl-beta-galactopyranoside, 3,4-Dinitrophenyl beta-D-galactopyranoside, (2S,3R,4S,5R,6R)-2-(3,4-dinitrophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol, RefChem:91234
| Molecular Formula | C12H14N2O10 |
|---|---|
| Molecular Weight | 346.06 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 191.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 346.06485 |
| Heavy Atoms | 24 |
| Complexity | 466.0 |
Chemical Identifiers
| CAS Number | 85668-54-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | AXPKTIFWSNCTCQ-YBXAARCKSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4-Dinitrophenyl-beta-galactopyranoside (CAS 85668-54-8), with molecular formula C12H14N2O10 and molecular weight 346.06 g/mol. IUPAC: (2S,3R,4S,5R,6R)-2-(3,4-dinitrophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol.
Chemical Property Profile of 3,4-Dinitrophenyl-beta-galactopyranoside
Property Insights of 3,4-Dinitrophenyl-beta-galactopyranoside
The XLogP value of -0.7 indicates that 3,4-Dinitrophenyl-beta-galactopyranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 191.0 Ų indicates high polarity, suggesting 3,4-Dinitrophenyl-beta-galactopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,4-Dinitrophenyl-beta-galactopyranoside has 4 hydrogen bond donor(s) and 10 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 3,4-Dinitrophenyl-beta-galactopyranoside?
The CAS number of 3,4-Dinitrophenyl-beta-galactopyranoside is 85668-54-8.
What is the molecular formula of 3,4-Dinitrophenyl-beta-galactopyranoside?
The molecular formula of 3,4-Dinitrophenyl-beta-galactopyranoside is C12H14N2O10.
What is the molecular weight of 3,4-Dinitrophenyl-beta-galactopyranoside?
The molecular weight of 3,4-Dinitrophenyl-beta-galactopyranoside is 346.06 g/mol.
Where can I buy 3,4-Dinitrophenyl-beta-galactopyranoside?
You can request a quote for 3,4-Dinitrophenyl-beta-galactopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dinitrophenyl-beta-galactopyranoside?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dinitrophenyl-beta-galactopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.