1-Amino-1-deoxy-D-fructose Acetate
TL;DR: 1-Amino-1-deoxy-D-fructose Acetate (CAS 54990-71-5) is a chemical compound with molecular formula C8H17NO7 and molecular weight 239.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetic acid;(3S,4R,5R)-1-amino-3,4,5,6-tetrahydroxyhexan-2-one
Also Known As: 1-Amino-1-deoxy-D-fructose Acetate, D-Fructose, 1-amino-1-deoxy-, acetate (ester), 1-Amino-1-deoxy-D-fructose acetate (ester), Acetic acid--1-amino-1-deoxy-D-fructose (1/1), acetic acid; (3S,4R,5R)-1-amino-3,4,5,6-tetrahydroxyhexan-2-one
| Molecular Formula | C8H17NO7 |
|---|---|
| Molecular Weight | 239.10 g/mol |
| LogP | -3.3199 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 239.1005 |
| Heavy Atoms | 16 |
| Complexity | 182.0 |
Chemical Identifiers
| CAS Number | 54990-71-5 |
|---|---|
| SMILES | CC(=O)O.C([C@H]([C@H]([C@@H](C(=O)CN)O)O)O)O |
| InChIKey | MJTNICQSTIRWQM-RWOHWRPJSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Amino-1-deoxy-D-fructose Acetate (CAS 54990-71-5), with molecular formula C8H17NO7 and molecular weight 239.10 g/mol. IUPAC: acetic acid;(3S,4R,5R)-1-amino-3,4,5,6-tetrahydroxyhexan-2-one.
Chemical Property Profile of 1-Amino-1-deoxy-D-fructose Acetate
Property Insights of 1-Amino-1-deoxy-D-fructose Acetate
The XLogP value of -3.3199 indicates that 1-Amino-1-deoxy-D-fructose Acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting 1-Amino-1-deoxy-D-fructose Acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-Amino-1-deoxy-D-fructose Acetate has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Amino-1-deoxy-D-fructose Acetate?
The CAS number of 1-Amino-1-deoxy-D-fructose Acetate is 54990-71-5.
What is the molecular formula of 1-Amino-1-deoxy-D-fructose Acetate?
The molecular formula of 1-Amino-1-deoxy-D-fructose Acetate is C8H17NO7.
What is the molecular weight of 1-Amino-1-deoxy-D-fructose Acetate?
The molecular weight of 1-Amino-1-deoxy-D-fructose Acetate is 239.10 g/mol.
Where can I buy 1-Amino-1-deoxy-D-fructose Acetate?
You can request a quote for 1-Amino-1-deoxy-D-fructose Acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Amino-1-deoxy-D-fructose Acetate?
Yes, KEHONG BIO provides custom synthesis services for 1-Amino-1-deoxy-D-fructose Acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.