2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol
TL;DR: 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol (CAS 1174429-88-9) is a chemical compound with molecular formula C12H16N2O7 and molecular weight 300.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol
Also Known As: N-{2-nitrophenyl}hexopyranosylamine, BAS 00337471, 2-(hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol, AB-323/13887107, 2-Hydroxymethyl-6-(2-nitro-phenylamino)-tetrahydro-pyran-3,4,5-triol
| Molecular Formula | C12H16N2O7 |
|---|---|
| Molecular Weight | 300.10 g/mol |
| LogP | -1.1934 |
| Topological Polar Surface Area | 145.32 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.09576 |
| Heavy Atoms | 21 |
| Complexity | 510.13425 |
Chemical Identifiers
| CAS Number | 1174429-88-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC2C(C(C(C(O2)CO)O)O)O)[N+](=O)[O-] |
Product Overview
2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol (CAS 1174429-88-9), with molecular formula C12H16N2O7 and molecular weight 300.10 g/mol. IUPAC: 2-(hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol.
Chemical Property Profile of 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol
Property Insights of 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol
The XLogP value of -1.1934 indicates that 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 145.32 Ų indicates high polarity, suggesting 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol has 5 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 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol?
The CAS number of 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol is 1174429-88-9.
What is the molecular formula of 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol?
The molecular formula of 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol is C12H16N2O7.
What is the molecular weight of 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol?
The molecular weight of 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol is 300.10 g/mol.
Where can I buy 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol?
You can request a quote for 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol?
Yes, KEHONG BIO provides custom synthesis services for 2-(Hydroxymethyl)-6-(2-nitroanilino)oxane-3,4,5-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.