Methyl 3-ethyl-2-iodobenzoate
TL;DR: Methyl 3-ethyl-2-iodobenzoate (CAS 28455-63-2) is a chemical compound with molecular formula C10H11IO2 and molecular weight 289.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-ethyl-2-iodobenzoate
Also Known As: methyl 3-ethyl-2-iodobenzoate, Methyl-2-iod-3-ethylbenzoat, Methyl 3-ethyl-2-iodo-benzoate, RefChem:354977
| Molecular Formula | C10H11IO2 |
|---|---|
| Molecular Weight | 289.98 g/mol |
| LogP | 2.6402 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 289.98038 |
| Heavy Atoms | 13 |
| Complexity | 320.70084 |
Chemical Identifiers
| CAS Number | 28455-63-2 |
|---|---|
| SMILES | CCC1=C(C(=CC=C1)C(=O)OC)I |
Product Overview
Methyl 3-ethyl-2-iodobenzoate (CAS 28455-63-2), with molecular formula C10H11IO2 and molecular weight 289.98 g/mol. IUPAC: methyl 3-ethyl-2-iodobenzoate.
Chemical Property Profile of Methyl 3-ethyl-2-iodobenzoate
Property Insights of Methyl 3-ethyl-2-iodobenzoate
The XLogP value of 2.6402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-ethyl-2-iodobenzoate. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 3-ethyl-2-iodobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-ethyl-2-iodobenzoate has 0 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 Methyl 3-ethyl-2-iodobenzoate?
The CAS number of Methyl 3-ethyl-2-iodobenzoate is 28455-63-2.
What is the molecular formula of Methyl 3-ethyl-2-iodobenzoate?
The molecular formula of Methyl 3-ethyl-2-iodobenzoate is C10H11IO2.
What is the molecular weight of Methyl 3-ethyl-2-iodobenzoate?
The molecular weight of Methyl 3-ethyl-2-iodobenzoate is 289.98 g/mol.
Where can I buy Methyl 3-ethyl-2-iodobenzoate?
You can request a quote for Methyl 3-ethyl-2-iodobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-ethyl-2-iodobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-ethyl-2-iodobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.