RefChem:446104
TL;DR: RefChem:446104 (CAS 68084-16-2) is a chemical compound with molecular formula C18H17N3O8S2 and molecular weight 467.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-amino-5-methoxy-2-methylphenyl)diazenyl]-5-hydroxynaphthalene-2,7-disulfonic acid
Also Known As: 2,7-Naphthalenedisulfonic acid, 4-[(4-amino-5-methoxy-2-methylphenyl)azo]-5-hydroxy-, 2,7-Naphthalenedisulfonic acid, 4-((4-amino-5-methoxy-2-methylphenyl)azo)-5-hydroxy-, 2,7-Naphthalenedisulfonic acid, 4-(2-(4-amino-5-methoxy-2-methylphenyl)diazenyl)-5-hydroxy-, 4-[(e)-(4-amino-5-methoxy-2-methylphenyl)diazenyl]-5-hydroxynaphthalene-2,7-disulfonic acid, 4-Hydroxy-5-(4-amino-5-methoxy-2-methyl phenyl)azo-2,7-naphthalenedisulfonic acid
| Molecular Formula | C18H17N3O8S2 |
|---|---|
| Molecular Weight | 467.05 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 206.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 467.04572 |
| Heavy Atoms | 31 |
| Complexity | 869.0 |
Chemical Identifiers
| CAS Number | 68084-16-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3O)S(=O)(=O)O)OC)N |
| InChIKey | RRMNLFKNUMFJTH-UHFFFAOYSA-N |
Product Overview
RefChem:446104 (CAS 68084-16-2), with molecular formula C18H17N3O8S2 and molecular weight 467.05 g/mol. IUPAC: 4-[(4-amino-5-methoxy-2-methylphenyl)diazenyl]-5-hydroxynaphthalene-2,7-disulfonic acid.
Chemical Property Profile of RefChem:446104
Property Insights of RefChem:446104
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:446104. The TPSA of 206.0 Ų indicates high polarity, suggesting RefChem:446104 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:446104 has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:446104?
The CAS number of RefChem:446104 is 68084-16-2.
What is the molecular formula of RefChem:446104?
The molecular formula of RefChem:446104 is C18H17N3O8S2.
What is the molecular weight of RefChem:446104?
The molecular weight of RefChem:446104 is 467.05 g/mol.
Where can I buy RefChem:446104?
You can request a quote for RefChem:446104 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:446104?
Yes, KEHONG BIO provides custom synthesis services for RefChem:446104 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.