Ethyl Hematommate
TL;DR: Ethyl Hematommate (CAS 39503-14-5) is a chemical compound with molecular formula C11H12O5 and molecular weight 224.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-formyl-2,4-dihydroxy-6-methylbenzoate
Also Known As: Ethyl hematommate, Ethyl haematommate, ethyl 3-formyl-2,4-dihydroxy-6-methylbenzoate, HAEMATOMMIC ACID, ETHYL ESTER, Spectrum2_000629
| Molecular Formula | C11H12O5 |
|---|---|
| Molecular Weight | 224.07 g/mol |
| LogP | 1.39542 |
| Topological Polar Surface Area | 83.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.06847 |
| Heavy Atoms | 16 |
| Complexity | 436.49133 |
Chemical Identifiers
| CAS Number | 39503-14-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(C(=C(C=C1C)O)C=O)O |
Product Overview
Ethyl Hematommate (CAS 39503-14-5), with molecular formula C11H12O5 and molecular weight 224.07 g/mol. IUPAC: ethyl 3-formyl-2,4-dihydroxy-6-methylbenzoate.
Chemical Property Profile of Ethyl Hematommate
Property Insights of Ethyl Hematommate
The XLogP value of 1.39542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl Hematommate. The TPSA of 83.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl Hematommate. Following Lipinski's Rule of Five, Ethyl Hematommate has 2 hydrogen bond donor(s) and 5 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 Ethyl Hematommate?
The CAS number of Ethyl Hematommate is 39503-14-5.
What is the molecular formula of Ethyl Hematommate?
The molecular formula of Ethyl Hematommate is C11H12O5.
What is the molecular weight of Ethyl Hematommate?
The molecular weight of Ethyl Hematommate is 224.07 g/mol.
Where can I buy Ethyl Hematommate?
You can request a quote for Ethyl Hematommate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl Hematommate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl Hematommate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.