5-氨基-2,4-二甲基苯磺酸
TL;DR: 5-氨基-2,4-二甲基苯磺酸 (CAS 6370-23-6) is a chemical compound with molecular formula C8H11NO3S and molecular weight 201.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-氨基-2,4-二甲基苯磺酸
5-amino-2,4-dimethylbenzenesulfonic acid
Also Known As: 5-Amino-2,4-dimethylbenzenesulfonic acid, 6-Amino-m-xylene-4-sulphonic acid, 2,4-Dimethylaniline-5-sulfonic acid, 2, 5-amino-, 2,4-Xylenesulfonic acid, 5-amino-
| Molecular Formula | C8H11NO3S |
|---|---|
| Molecular Weight | 201.05 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 88.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.04596 |
| Heavy Atoms | 13 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 6370-23-6 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N)S(=O)(=O)O)C |
| InChIKey | NTPCHAXHWPDMEI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-氨基-2,4-二甲基苯磺酸 (CAS 6370-23-6), with molecular formula C8H11NO3S and molecular weight 201.05 g/mol. IUPAC: 5-amino-2,4-dimethylbenzenesulfonic acid.
Chemical Property Profile of 5-氨基-2,4-二甲基苯磺酸
Property Insights of 5-氨基-2,4-二甲基苯磺酸
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-氨基-2,4-二甲基苯磺酸. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-氨基-2,4-二甲基苯磺酸. Following Lipinski's Rule of Five, 5-氨基-2,4-二甲基苯磺酸 has 2 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-氨基-2,4-二甲基苯磺酸?
The CAS number of 5-氨基-2,4-二甲基苯磺酸 is 6370-23-6.
What is the molecular formula of 5-氨基-2,4-二甲基苯磺酸?
The molecular formula of 5-氨基-2,4-二甲基苯磺酸 is C8H11NO3S.
What is the molecular weight of 5-氨基-2,4-二甲基苯磺酸?
The molecular weight of 5-氨基-2,4-二甲基苯磺酸 is 201.05 g/mol.
Where can I buy 5-氨基-2,4-二甲基苯磺酸?
You can request a quote for 5-氨基-2,4-二甲基苯磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-氨基-2,4-二甲基苯磺酸?
Yes, KEHONG BIO provides custom synthesis services for 5-氨基-2,4-二甲基苯磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.