3-硝基苯基-β-D-吡喃葡萄糖苷
TL;DR: 3-硝基苯基-β-D-吡喃葡萄糖苷 (CAS 52571-71-8) is a chemical compound with molecular formula C12H15NO8 and molecular weight 301.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-硝基苯基-β-D-吡喃葡萄糖苷
2-(hydroxymethyl)-6-(3-nitrophenoxy)oxane-3,4,5-triol
Also Known As: 3-Nitrophenyl-b-D-glucopyranoside, metanitrophenyl-alpha-d-galactoside, 3-Nitrophenyl beta-D-galactopyranoside, 3-Nitrophenyl b-D-galactopyranoside, a-D-Galactopyranoside,3-nitrophenyl
| Molecular Formula | C12H15NO8 |
|---|---|
| Molecular Weight | 301.08 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.07977 |
| Heavy Atoms | 21 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 52571-71-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2C(C(C(C(O2)CO)O)O)O)[N+](=O)[O-] |
| InChIKey | VCCMGHVCRFMITI-UHFFFAOYSA-N |
Product Overview
3-硝基苯基-β-D-吡喃葡萄糖苷 (CAS 52571-71-8), with molecular formula C12H15NO8 and molecular weight 301.08 g/mol. IUPAC: 2-(hydroxymethyl)-6-(3-nitrophenoxy)oxane-3,4,5-triol.
Chemical Property Profile of 3-硝基苯基-β-D-吡喃葡萄糖苷
Property Insights of 3-硝基苯基-β-D-吡喃葡萄糖苷
The XLogP value of -0.5 indicates that 3-硝基苯基-β-D-吡喃葡萄糖苷 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 145.0 Ų indicates high polarity, suggesting 3-硝基苯基-β-D-吡喃葡萄糖苷 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C12H15NO8 has 4 hydrogen bond donor(s) and 8 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 C12H15NO8?
The CAS number of C12H15NO8 is 52571-71-8.
What is the molecular formula of C12H15NO8?
The molecular formula of C12H15NO8 is C12H15NO8.
What is the molecular weight of C12H15NO8?
The molecular weight of C12H15NO8 is 301.08 g/mol.
Where can I buy C12H15NO8?
You can request a quote for C12H15NO8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C12H15NO8?
Yes, KEHONG BIO provides custom synthesis services for C12H15NO8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.