5,6,7,8-Tetrahydronaphthalene-1,6,7-triol
TL;DR: 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol (CAS 35697-16-6) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,6,7,8-tetrahydronaphthalene-1,6,7-triol
Also Known As: 5,6,7,8-tetrahydronaphthalene-1,6,7-triol, EINECS 252-682-6, 5,6,7,8-Tetrahydro-1,6,7-naphthalenetriol, Cis-5,6,7,8-terahydrogen-6,7-dihydroxy-1-naphthol, cis-5,6,7,8-Tetrahydronaphthalene-1,6,7-triol
| Molecular Formula | C10H12O3 |
|---|---|
| Molecular Weight | 180.08 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.07864 |
| Heavy Atoms | 13 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 35697-16-6 |
|---|---|
| SMILES | C1C(C(CC2=C1C=CC=C2O)O)O |
| InChIKey | AUKZSCHMOAPNEN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,6,7,8-Tetrahydronaphthalene-1,6,7-triol (CAS 35697-16-6), with molecular formula C10H12O3 and molecular weight 180.08 g/mol. IUPAC: 5,6,7,8-tetrahydronaphthalene-1,6,7-triol.
Chemical Property Profile of 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol
Property Insights of 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol. Following Lipinski's Rule of Five, 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol has 3 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 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol?
The CAS number of 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol is 35697-16-6.
What is the molecular formula of 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol?
The molecular formula of 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol is C10H12O3.
What is the molecular weight of 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol?
The molecular weight of 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol is 180.08 g/mol.
Where can I buy 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol?
You can request a quote for 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol?
Yes, KEHONG BIO provides custom synthesis services for 5,6,7,8-Tetrahydronaphthalene-1,6,7-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.