Phenylazomethyl benzoate
TL;DR: Phenylazomethyl benzoate (CAS 63528-74-5) is a chemical compound with molecular formula C14H12N2O2 and molecular weight 240.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyldiazenylmethyl benzoate
Also Known As: Phenylazomethyl benzoate, phenyldiazenylmethyl benzoate, (Phenylazo)methanol benzoate (ester), Methanol, (phenylazo)-, benzoate (ester)
| Molecular Formula | C14H12N2O2 |
|---|---|
| Molecular Weight | 240.09 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 51.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 240.08987 |
| Heavy Atoms | 18 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 63528-74-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OCN=NC2=CC=CC=C2 |
| InChIKey | CMVGAEFXQFHTRO-UHFFFAOYSA-N |
Product Overview
Phenylazomethyl benzoate (CAS 63528-74-5), with molecular formula C14H12N2O2 and molecular weight 240.09 g/mol. IUPAC: phenyldiazenylmethyl benzoate.
Chemical Property Profile of Phenylazomethyl benzoate
Property Insights of Phenylazomethyl benzoate
The XLogP value of 3.6 indicates that Phenylazomethyl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.0 Ų, Phenylazomethyl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenylazomethyl benzoate 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 Phenylazomethyl benzoate?
The CAS number of Phenylazomethyl benzoate is 63528-74-5.
What is the molecular formula of Phenylazomethyl benzoate?
The molecular formula of Phenylazomethyl benzoate is C14H12N2O2.
What is the molecular weight of Phenylazomethyl benzoate?
The molecular weight of Phenylazomethyl benzoate is 240.09 g/mol.
Where can I buy Phenylazomethyl benzoate?
You can request a quote for Phenylazomethyl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenylazomethyl benzoate?
Yes, KEHONG BIO provides custom synthesis services for Phenylazomethyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.