6,7-Dimethylnaphthalene-1-ol
TL;DR: 6,7-Dimethylnaphthalene-1-ol (CAS 31776-14-4) is a chemical compound with molecular formula C12H12O and molecular weight 172.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,7-dimethylnaphthalen-1-ol
Also Known As: 6,7-Dimethylnaphthalene-1-ol, 6,7-Dimethyl-1-naphthol, 6,7-dimethylnaphthalen-1-ol, 1-Naphthol, 6,7-dimethyl-, 6,7-Dimethyl-1-naphthol #
| Molecular Formula | C12H12O |
|---|---|
| Molecular Weight | 172.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.08882 |
| Heavy Atoms | 13 |
| Complexity | 178.0 |
Chemical Identifiers
| CAS Number | 31776-14-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)C(=CC=C2)O |
| InChIKey | JHGMBKMPUBNWBB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6,7-Dimethylnaphthalene-1-ol (CAS 31776-14-4), with molecular formula C12H12O and molecular weight 172.09 g/mol. IUPAC: 6,7-dimethylnaphthalen-1-ol.
Chemical Property Profile of 6,7-Dimethylnaphthalene-1-ol
Property Insights of 6,7-Dimethylnaphthalene-1-ol
The XLogP value of 3.5 indicates that 6,7-Dimethylnaphthalene-1-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 6,7-Dimethylnaphthalene-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,7-Dimethylnaphthalene-1-ol has 1 hydrogen bond donor(s) and 1 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 6,7-Dimethylnaphthalene-1-ol?
The CAS number of 6,7-Dimethylnaphthalene-1-ol is 31776-14-4.
What is the molecular formula of 6,7-Dimethylnaphthalene-1-ol?
The molecular formula of 6,7-Dimethylnaphthalene-1-ol is C12H12O.
What is the molecular weight of 6,7-Dimethylnaphthalene-1-ol?
The molecular weight of 6,7-Dimethylnaphthalene-1-ol is 172.09 g/mol.
Where can I buy 6,7-Dimethylnaphthalene-1-ol?
You can request a quote for 6,7-Dimethylnaphthalene-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,7-Dimethylnaphthalene-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 6,7-Dimethylnaphthalene-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.