2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol
TL;DR: 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol (CAS 80464-90-0) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol
Also Known As: 2-methoxy-5-(3-methyl-2-butenyl)hydroquinone, 2-methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol, 2-Methoxy-5-(3-methylbut-2-en-1-yl)benzene-1,4-diol
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 80464-90-0 |
|---|---|
| SMILES | CC(=CCC1=CC(=C(C=C1O)OC)O)C |
| InChIKey | DYPJHBZGSJINJI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol (CAS 80464-90-0), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: 2-methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol.
Chemical Property Profile of 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol
Property Insights of 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol
The XLogP value of 3.1 indicates that 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-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 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol?
The CAS number of 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol is 80464-90-0.
What is the molecular formula of 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol?
The molecular formula of 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol is C12H16O3.
What is the molecular weight of 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol?
The molecular weight of 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol is 208.11 g/mol.
Where can I buy 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol?
You can request a quote for 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-5-(3-methylbut-2-enyl)benzene-1,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.