6-Hydroxybenzothiazole
TL;DR: 6-Hydroxybenzothiazole (CAS 13599-84-3) is a chemical compound with molecular formula C7H5NOS and molecular weight 151.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzothiazol-6-ol
Also Known As: 6-Hydroxybenzothiazole, benzo[d]thiazol-6-ol, 1,3-benzothiazol-6-ol, 6-Benzothiazolol, benzothiazol-6-ol
| Molecular Formula | C7H5NOS |
|---|---|
| Molecular Weight | 151.01 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 151.00919 |
| Heavy Atoms | 10 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 13599-84-3 |
|---|---|
| SMILES | C1=CC2=C(C=C1O)SC=N2 |
| InChIKey | ORIIXCOYEOIFSN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Hydroxybenzothiazole (CAS 13599-84-3), with molecular formula C7H5NOS and molecular weight 151.01 g/mol. IUPAC: 1,3-benzothiazol-6-ol.
Chemical Property Profile of 6-Hydroxybenzothiazole
Property Insights of 6-Hydroxybenzothiazole
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Hydroxybenzothiazole. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Hydroxybenzothiazole. Following Lipinski's Rule of Five, 6-Hydroxybenzothiazole has 1 hydrogen bond donor(s) and 3 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 6-Hydroxybenzothiazole?
The CAS number of 6-Hydroxybenzothiazole is 13599-84-3.
What is the molecular formula of 6-Hydroxybenzothiazole?
The molecular formula of 6-Hydroxybenzothiazole is C7H5NOS.
What is the molecular weight of 6-Hydroxybenzothiazole?
The molecular weight of 6-Hydroxybenzothiazole is 151.01 g/mol.
Where can I buy 6-Hydroxybenzothiazole?
You can request a quote for 6-Hydroxybenzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxybenzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxybenzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.