3,5-二乙基-4-羟基苯甲酸
TL;DR: 3,5-二乙基-4-羟基苯甲酸 (CAS 7192-42-9) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-二乙基-4-羟基苯甲酸
3,5-diethyl-4-hydroxybenzoic acid
Also Known As: 3,5-Diethyl-4-hydroxybenzoic acid, BENZOIC ACID, 3,5-DIETHYL-4-HYDROXY-, BRN 2616918, RefChem:327069
| Molecular Formula | C11H14O3 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.0943 |
| Heavy Atoms | 14 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 7192-42-9 |
|---|---|
| SMILES | CCC1=CC(=CC(=C1O)CC)C(=O)O |
| InChIKey | XBPUEQBTSNGZMZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-二乙基-4-羟基苯甲酸 (CAS 7192-42-9), with molecular formula C11H14O3 and molecular weight 194.09 g/mol. IUPAC: 3,5-diethyl-4-hydroxybenzoic acid.
Chemical Property Profile of 3,5-二乙基-4-羟基苯甲酸
Property Insights of 3,5-二乙基-4-羟基苯甲酸
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-二乙基-4-羟基苯甲酸. With a topological polar surface area (TPSA) of 57.5 Ų, 3,5-二乙基-4-羟基苯甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-二乙基-4-羟基苯甲酸 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 3,5-二乙基-4-羟基苯甲酸?
The CAS number of 3,5-二乙基-4-羟基苯甲酸 is 7192-42-9.
What is the molecular formula of 3,5-二乙基-4-羟基苯甲酸?
The molecular formula of 3,5-二乙基-4-羟基苯甲酸 is C11H14O3.
What is the molecular weight of 3,5-二乙基-4-羟基苯甲酸?
The molecular weight of 3,5-二乙基-4-羟基苯甲酸 is 194.09 g/mol.
Where can I buy 3,5-二乙基-4-羟基苯甲酸?
You can request a quote for 3,5-二乙基-4-羟基苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-二乙基-4-羟基苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 3,5-二乙基-4-羟基苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.