N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine
TL;DR: N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine (CAS 111858-68-5) is a chemical compound with molecular formula C13H18N2O6 and molecular weight 298.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-methylphenyl)-N-[[(3S,4R,5R)-2,3,4,5-tetrahydroxyoxan-2-yl]methyl]nitrous amide
Also Known As: N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine, N-Nitroso-N-p-tolyl-D-fructopyranosylamine, D-Fructopyranosylamine, N-nitroso-N-p-tolyl-, D-Fructopyranose, 1-deoxy-1-((4-methylphenyl)nitrosoamino)-, 1-deoxy-1-[(4-methylphenyl)(nitroso)amino]-D-fructopyranose
| Molecular Formula | C13H18N2O6 |
|---|---|
| Molecular Weight | 298.12 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 123.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.1165 |
| Heavy Atoms | 21 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 111858-68-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N(CC2([C@H]([C@@H]([C@@H](CO2)O)O)O)O)N=O |
| InChIKey | PTAFVMYPDHJIFU-FKJOKYEKSA-N |
Product Overview
N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine (CAS 111858-68-5), with molecular formula C13H18N2O6 and molecular weight 298.12 g/mol. IUPAC: N-(4-methylphenyl)-N-[[(3S,4R,5R)-2,3,4,5-tetrahydroxyoxan-2-yl]methyl]nitrous amide.
Chemical Property Profile of N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine
Property Insights of N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine
The XLogP value of -0.8 indicates that N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine. Following Lipinski's Rule of Five, N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine 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 N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine?
The CAS number of N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine is 111858-68-5.
What is the molecular formula of N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine?
The molecular formula of N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine is C13H18N2O6.
What is the molecular weight of N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine?
The molecular weight of N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine is 298.12 g/mol.
Where can I buy N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine?
You can request a quote for N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine?
Yes, KEHONG BIO provides custom synthesis services for N-Nitroso-N-p-methylphenyl-1-deoxy-D-fructosylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.