Ethyl (3-formylphenyl) carbonate
TL;DR: Ethyl (3-formylphenyl) carbonate (CAS 68423-35-8) is a chemical compound with molecular formula C10H10O4 and molecular weight 194.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (3-formylphenyl) carbonate
Also Known As: ethyl (3-formylphenyl) carbonate, ethyl 3-formylphenyl carbonate, Carbonic acid, ethyl 3-formylphenyl ester, 10.14272/OMORBSHREBRXKO-UHFFFAOYSA-N, 10.14272/OMORBSHREBRXKO-UHFFFAOYSA-N.1
| Molecular Formula | C10H10O4 |
|---|---|
| Molecular Weight | 194.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 194.0579 |
| Heavy Atoms | 14 |
| Complexity | 202.0 |
Chemical Identifiers
| CAS Number | 68423-35-8 |
|---|---|
| SMILES | CCOC(=O)OC1=CC=CC(=C1)C=O |
| InChIKey | OMORBSHREBRXKO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl (3-formylphenyl) carbonate (CAS 68423-35-8), with molecular formula C10H10O4 and molecular weight 194.06 g/mol. IUPAC: ethyl (3-formylphenyl) carbonate.
Chemical Property Profile of Ethyl (3-formylphenyl) carbonate
Property Insights of Ethyl (3-formylphenyl) carbonate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl (3-formylphenyl) carbonate. With a topological polar surface area (TPSA) of 52.6 Ų, Ethyl (3-formylphenyl) carbonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (3-formylphenyl) carbonate 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 Ethyl (3-formylphenyl) carbonate?
The CAS number of Ethyl (3-formylphenyl) carbonate is 68423-35-8.
What is the molecular formula of Ethyl (3-formylphenyl) carbonate?
The molecular formula of Ethyl (3-formylphenyl) carbonate is C10H10O4.
What is the molecular weight of Ethyl (3-formylphenyl) carbonate?
The molecular weight of Ethyl (3-formylphenyl) carbonate is 194.06 g/mol.
Where can I buy Ethyl (3-formylphenyl) carbonate?
You can request a quote for Ethyl (3-formylphenyl) carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl (3-formylphenyl) carbonate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (3-formylphenyl) carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.