3-Formylphenyl 4-methoxybenzoate
TL;DR: 3-Formylphenyl 4-methoxybenzoate (CAS 42517-23-7) is a chemical compound with molecular formula C15H12O4 and molecular weight 256.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-formylphenyl) 4-methoxybenzoate
Also Known As: 3-formylphenyl 4-methoxybenzoate, (3-formylphenyl) 4-methoxybenzoate, 3-formylphenyl4-methoxybenzoate, 2-Isopropyl-benzothiazol-6-ylamine, Benzoic acid, 4-methoxy-, 3-formylphenyl ester
| Molecular Formula | C15H12O4 |
|---|---|
| Molecular Weight | 256.07 g/mol |
| LogP | 2.7269 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 256.07355 |
| Heavy Atoms | 19 |
| Complexity | 587.3495 |
Chemical Identifiers
| CAS Number | 42517-23-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C=O |
Product Overview
3-Formylphenyl 4-methoxybenzoate (CAS 42517-23-7), with molecular formula C15H12O4 and molecular weight 256.07 g/mol. IUPAC: (3-formylphenyl) 4-methoxybenzoate.
Chemical Property Profile of 3-Formylphenyl 4-methoxybenzoate
Property Insights of 3-Formylphenyl 4-methoxybenzoate
The XLogP value of 2.7269 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Formylphenyl 4-methoxybenzoate. With a topological polar surface area (TPSA) of 52.6 Ų, 3-Formylphenyl 4-methoxybenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Formylphenyl 4-methoxybenzoate 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-Formylphenyl 4-methoxybenzoate?
The CAS number of 3-Formylphenyl 4-methoxybenzoate is 42517-23-7.
What is the molecular formula of 3-Formylphenyl 4-methoxybenzoate?
The molecular formula of 3-Formylphenyl 4-methoxybenzoate is C15H12O4.
What is the molecular weight of 3-Formylphenyl 4-methoxybenzoate?
The molecular weight of 3-Formylphenyl 4-methoxybenzoate is 256.07 g/mol.
Where can I buy 3-Formylphenyl 4-methoxybenzoate?
You can request a quote for 3-Formylphenyl 4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Formylphenyl 4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 3-Formylphenyl 4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.