5-Amino-6-hydroxytoluene-3-sulphonic acid
TL;DR: 5-Amino-6-hydroxytoluene-3-sulphonic acid (CAS 94442-01-0) is a chemical compound with molecular formula C7H9NO4S and molecular weight 203.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-4-hydroxy-5-methylbenzenesulfonic acid
Also Known As: 5-Amino-6-hydroxytoluene-3-sulphonic acid, EINECS 305-327-5, 3-amino-4-hydroxy-5-methylbenzenesulfonic acid, 5-AMINO-6-HYDROXYTOLUENE-3-SULFONIC ACID, 3-amino-4-hydroxy-5-methylbenzene-1-sulfonic acid
| Molecular Formula | C7H9NO4S |
|---|---|
| Molecular Weight | 203.03 g/mol |
| LogP | 0.52952 |
| Topological Polar Surface Area | 100.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.02522 |
| Heavy Atoms | 13 |
| Complexity | 414.80093 |
Chemical Identifiers
| CAS Number | 94442-01-0 |
|---|---|
| SMILES | CC1=CC(=CC(=C1O)N)S(=O)(=O)O |
Product Overview
5-Amino-6-hydroxytoluene-3-sulphonic acid (CAS 94442-01-0), with molecular formula C7H9NO4S and molecular weight 203.03 g/mol. IUPAC: 3-amino-4-hydroxy-5-methylbenzenesulfonic acid.
Chemical Property Profile of 5-Amino-6-hydroxytoluene-3-sulphonic acid
Property Insights of 5-Amino-6-hydroxytoluene-3-sulphonic acid
The XLogP value of 0.52952 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Amino-6-hydroxytoluene-3-sulphonic acid. The TPSA of 100.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Amino-6-hydroxytoluene-3-sulphonic acid. Following Lipinski's Rule of Five, 5-Amino-6-hydroxytoluene-3-sulphonic acid has 3 hydrogen bond donor(s) and 4 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 5-Amino-6-hydroxytoluene-3-sulphonic acid?
The CAS number of 5-Amino-6-hydroxytoluene-3-sulphonic acid is 94442-01-0.
What is the molecular formula of 5-Amino-6-hydroxytoluene-3-sulphonic acid?
The molecular formula of 5-Amino-6-hydroxytoluene-3-sulphonic acid is C7H9NO4S.
What is the molecular weight of 5-Amino-6-hydroxytoluene-3-sulphonic acid?
The molecular weight of 5-Amino-6-hydroxytoluene-3-sulphonic acid is 203.03 g/mol.
Where can I buy 5-Amino-6-hydroxytoluene-3-sulphonic acid?
You can request a quote for 5-Amino-6-hydroxytoluene-3-sulphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Amino-6-hydroxytoluene-3-sulphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Amino-6-hydroxytoluene-3-sulphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.