4-Ethyl-3-fluorobenzene-1,2-diol
TL;DR: 4-Ethyl-3-fluorobenzene-1,2-diol (CAS 158641-49-7) is a chemical compound with molecular formula C8H9FO2 and molecular weight 156.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-3-fluorobenzene-1,2-diol
Also Known As: 4-ethyl-3-fluorobenzene-1,2-diol, 1,2-Benzenediol, 4-ethyl-3-fluoro-, 4-ethyl-3-fluoro-benzene-1,2-diol, 1,2-Benzenediol, 4-ethyl-3-fluoro-, InChI=1/C8H9FO2/c1-2-5-3-4-6(10)8(11)7(5)9/h3-4,10-11H,2H2,1H
| Molecular Formula | C8H9FO2 |
|---|---|
| Molecular Weight | 156.06 g/mol |
| LogP | 1.7993 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.05865 |
| Heavy Atoms | 11 |
| Complexity | 271.03973 |
Chemical Identifiers
| CAS Number | 158641-49-7 |
|---|---|
| SMILES | CCC1=C(C(=C(C=C1)O)O)F |
Product Overview
4-Ethyl-3-fluorobenzene-1,2-diol (CAS 158641-49-7), with molecular formula C8H9FO2 and molecular weight 156.06 g/mol. IUPAC: 4-ethyl-3-fluorobenzene-1,2-diol.
Chemical Property Profile of 4-Ethyl-3-fluorobenzene-1,2-diol
Property Insights of 4-Ethyl-3-fluorobenzene-1,2-diol
The XLogP value of 1.7993 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Ethyl-3-fluorobenzene-1,2-diol. With a topological polar surface area (TPSA) of 40.46 Ų, 4-Ethyl-3-fluorobenzene-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethyl-3-fluorobenzene-1,2-diol has 2 hydrogen bond donor(s) and 2 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 4-Ethyl-3-fluorobenzene-1,2-diol?
The CAS number of 4-Ethyl-3-fluorobenzene-1,2-diol is 158641-49-7.
What is the molecular formula of 4-Ethyl-3-fluorobenzene-1,2-diol?
The molecular formula of 4-Ethyl-3-fluorobenzene-1,2-diol is C8H9FO2.
What is the molecular weight of 4-Ethyl-3-fluorobenzene-1,2-diol?
The molecular weight of 4-Ethyl-3-fluorobenzene-1,2-diol is 156.06 g/mol.
Where can I buy 4-Ethyl-3-fluorobenzene-1,2-diol?
You can request a quote for 4-Ethyl-3-fluorobenzene-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethyl-3-fluorobenzene-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethyl-3-fluorobenzene-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.