铝试剂
TL;DR: 铝试剂 (CAS 569-58-4) is a chemical compound with molecular formula C22H17N3O9 and molecular weight 467.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
铝试剂
amino 5-[(3-aminooxycarbonyl-4-hydroxyphenyl)-(3-aminooxycarbonyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-hydroxybenzoate
Also Known As: ALuminon,AR, TG2-222-5, SMP2_000091, amino 5-[(3-aminooxycarbonyl-4-hydroxyphenyl)-(3-aminooxycarbonyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-hydroxybenzoate, 2-[(aminooxy)carbonyl]-4-(bis{3-[(aminooxy)carbonyl]-4-hydroxyphenyl}methylidene)cyclohexa-2,5-dien-1-one
| Molecular Formula | C22H17N3O9 |
|---|---|
| Molecular Weight | 467.10 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 214.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 467.09647 |
| Heavy Atoms | 34 |
| Complexity | 900.0 |
Chemical Identifiers
| CAS Number | 569-58-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=C2C=CC(=O)C(=C2)C(=O)ON)C3=CC(=C(C=C3)O)C(=O)ON)C(=O)ON)O |
| InChIKey | AQAOISHUOOXFDH-UHFFFAOYSA-N |
Product Overview
铝试剂 (CAS 569-58-4), with molecular formula C22H17N3O9 and molecular weight 467.10 g/mol. IUPAC: amino 5-[(3-aminooxycarbonyl-4-hydroxyphenyl)-(3-aminooxycarbonyl-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-hydroxybenzoate.
Chemical Property Profile of 铝试剂
Property Insights of 铝试剂
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 铝试剂. The TPSA of 214.0 Ų indicates high polarity, suggesting 铝试剂 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 铝试剂 has 5 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 铝试剂?
The CAS number of 铝试剂 is 569-58-4.
What is the molecular formula of 铝试剂?
The molecular formula of 铝试剂 is C22H17N3O9.
What is the molecular weight of 铝试剂?
The molecular weight of 铝试剂 is 467.10 g/mol.
Where can I buy 铝试剂?
You can request a quote for 铝试剂 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 铝试剂?
Yes, KEHONG BIO provides custom synthesis services for 铝试剂 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.