3,4,5-三甲氧基苯甲酰氯
TL;DR: 3,4,5-三甲氧基苯甲酰氯 (CAS 4521-61-3) is a chemical compound with molecular formula C10H11ClO4 and molecular weight 230.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-三甲氧基苯甲酰氯
3,4,5-trimethoxybenzoyl chloride
Also Known As: 3,4,5-Trimethoxybenzoyl chloride, Trimethylgalloyl chloride, Benzoyl chloride, 3,4,5-trimethoxy-, 4-Fluoroquinoline, Tri-O-methylgalloyl chloride
| Molecular Formula | C10H11ClO4 |
|---|---|
| Molecular Weight | 230.03 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.03459 |
| Heavy Atoms | 15 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 4521-61-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)Cl |
| InChIKey | BUHYMJLFRZAFBF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,4,5-三甲氧基苯甲酰氯 (CAS 4521-61-3), with molecular formula C10H11ClO4 and molecular weight 230.03 g/mol. IUPAC: 3,4,5-trimethoxybenzoyl chloride.
Chemical Property Profile of 3,4,5-三甲氧基苯甲酰氯
Property Insights of 3,4,5-三甲氧基苯甲酰氯
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,5-三甲氧基苯甲酰氯. With a topological polar surface area (TPSA) of 44.8 Ų, 3,4,5-三甲氧基苯甲酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4,5-三甲氧基苯甲酰氯 has 0 hydrogen bond donor(s) and 4 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 3,4,5-三甲氧基苯甲酰氯?
The CAS number of 3,4,5-三甲氧基苯甲酰氯 is 4521-61-3.
What is the molecular formula of 3,4,5-三甲氧基苯甲酰氯?
The molecular formula of 3,4,5-三甲氧基苯甲酰氯 is C10H11ClO4.
What is the molecular weight of 3,4,5-三甲氧基苯甲酰氯?
The molecular weight of 3,4,5-三甲氧基苯甲酰氯 is 230.03 g/mol.
Where can I buy 3,4,5-三甲氧基苯甲酰氯?
You can request a quote for 3,4,5-三甲氧基苯甲酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5-三甲氧基苯甲酰氯?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-三甲氧基苯甲酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.