2-Aminophenol glucuronide
TL;DR: 2-Aminophenol glucuronide (CAS 15959-03-2) is a chemical compound with molecular formula C12H15NO7 and molecular weight 285.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4S,5R,6S)-6-(2-aminophenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: 2-Aminophenylglucuronide, 2-Aminophenol Glucuronide, 2-Aminophenyl, A-D-Glucuronide, 2-Aminophenyl ?-D-Glucuronide
| Molecular Formula | C12H15NO7 |
|---|---|
| Molecular Weight | 285.08 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.08484 |
| Heavy Atoms | 20 |
| Complexity | 353.0 |
Chemical Identifiers
| CAS Number | 15959-03-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O |
| InChIKey | ZVFVTBSWJWONEI-GOVZDWNOSA-N |
Product Overview
2-Aminophenol glucuronide (CAS 15959-03-2), with molecular formula C12H15NO7 and molecular weight 285.08 g/mol. IUPAC: (2S,3S,4S,5R,6S)-6-(2-aminophenoxy)-3,4,5-trihydroxyoxane-2-carboxylic acid.
Chemical Property Profile of 2-Aminophenol glucuronide
Property Insights of 2-Aminophenol glucuronide
The XLogP value of -0.7 indicates that 2-Aminophenol glucuronide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 142.0 Ų indicates high polarity, suggesting 2-Aminophenol glucuronide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Aminophenol glucuronide 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-Aminophenol glucuronide?
The CAS number of 2-Aminophenol glucuronide is 15959-03-2.
What is the molecular formula of 2-Aminophenol glucuronide?
The molecular formula of 2-Aminophenol glucuronide is C12H15NO7.
What is the molecular weight of 2-Aminophenol glucuronide?
The molecular weight of 2-Aminophenol glucuronide is 285.08 g/mol.
Where can I buy 2-Aminophenol glucuronide?
You can request a quote for 2-Aminophenol glucuronide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Aminophenol glucuronide?
Yes, KEHONG BIO provides custom synthesis services for 2-Aminophenol glucuronide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.