5-Methoxy-2-methylbenzene-1,3-diol
TL;DR: 5-Methoxy-2-methylbenzene-1,3-diol (CAS 6970-72-5) is a chemical compound with molecular formula C8H10O3 and molecular weight 154.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methoxy-2-methylbenzene-1,3-diol
Also Known As: 5-methoxy-2-methylbenzene-1,3-diol, 2,6-DIHYDROXY-4-METHOXYTOLUENE, Spectrum2_001803, Spectrum3_001718, Spectrum4_001799
| Molecular Formula | C8H10O3 |
|---|---|
| Molecular Weight | 154.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.06299 |
| Heavy Atoms | 11 |
| Complexity | 115.0 |
Chemical Identifiers
| CAS Number | 6970-72-5 |
|---|---|
| SMILES | CC1=C(C=C(C=C1O)OC)O |
| InChIKey | YPIDZFLQKNEKRA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Methoxy-2-methylbenzene-1,3-diol (CAS 6970-72-5), with molecular formula C8H10O3 and molecular weight 154.06 g/mol. IUPAC: 5-methoxy-2-methylbenzene-1,3-diol.
Chemical Property Profile of 5-Methoxy-2-methylbenzene-1,3-diol
Property Insights of 5-Methoxy-2-methylbenzene-1,3-diol
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methoxy-2-methylbenzene-1,3-diol. With a topological polar surface area (TPSA) of 49.7 Ų, 5-Methoxy-2-methylbenzene-1,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methoxy-2-methylbenzene-1,3-diol has 2 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-Methoxy-2-methylbenzene-1,3-diol?
The CAS number of 5-Methoxy-2-methylbenzene-1,3-diol is 6970-72-5.
What is the molecular formula of 5-Methoxy-2-methylbenzene-1,3-diol?
The molecular formula of 5-Methoxy-2-methylbenzene-1,3-diol is C8H10O3.
What is the molecular weight of 5-Methoxy-2-methylbenzene-1,3-diol?
The molecular weight of 5-Methoxy-2-methylbenzene-1,3-diol is 154.06 g/mol.
Where can I buy 5-Methoxy-2-methylbenzene-1,3-diol?
You can request a quote for 5-Methoxy-2-methylbenzene-1,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methoxy-2-methylbenzene-1,3-diol?
Yes, KEHONG BIO provides custom synthesis services for 5-Methoxy-2-methylbenzene-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.