1-Phenyl-2-(m-tolylazo)-1,3-butanedione
TL;DR: 1-Phenyl-2-(m-tolylazo)-1,3-butanedione (CAS 3701-22-2) is a chemical compound with molecular formula C17H16N2O2 and molecular weight 280.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-methylphenyl)diazenyl]-1-phenylbutane-1,3-dione
Also Known As: 3-Tolyl-azo-benzoyl-aceton, 3-Tolyl-azo-benzoyl-aceton [German], 1-Phenyl-2-(m-tolylazo)-1,3-butanedione, F 2309, 1,3-BUTANEDIONE, 1-PHENYL-2-(m-TOLYLAZO)-
| Molecular Formula | C17H16N2O2 |
|---|---|
| Molecular Weight | 280.12 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 280.1212 |
| Heavy Atoms | 21 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 3701-22-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N=NC(C(=O)C)C(=O)C2=CC=CC=C2 |
| InChIKey | ASBFLDZZYNJTBC-UHFFFAOYSA-N |
Product Overview
1-Phenyl-2-(m-tolylazo)-1,3-butanedione (CAS 3701-22-2), with molecular formula C17H16N2O2 and molecular weight 280.12 g/mol. IUPAC: 2-[(3-methylphenyl)diazenyl]-1-phenylbutane-1,3-dione.
Chemical Property Profile of 1-Phenyl-2-(m-tolylazo)-1,3-butanedione
Property Insights of 1-Phenyl-2-(m-tolylazo)-1,3-butanedione
The XLogP value of 3.9 indicates that 1-Phenyl-2-(m-tolylazo)-1,3-butanedione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, 1-Phenyl-2-(m-tolylazo)-1,3-butanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-2-(m-tolylazo)-1,3-butanedione 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 1-Phenyl-2-(m-tolylazo)-1,3-butanedione?
The CAS number of 1-Phenyl-2-(m-tolylazo)-1,3-butanedione is 3701-22-2.
What is the molecular formula of 1-Phenyl-2-(m-tolylazo)-1,3-butanedione?
The molecular formula of 1-Phenyl-2-(m-tolylazo)-1,3-butanedione is C17H16N2O2.
What is the molecular weight of 1-Phenyl-2-(m-tolylazo)-1,3-butanedione?
The molecular weight of 1-Phenyl-2-(m-tolylazo)-1,3-butanedione is 280.12 g/mol.
Where can I buy 1-Phenyl-2-(m-tolylazo)-1,3-butanedione?
You can request a quote for 1-Phenyl-2-(m-tolylazo)-1,3-butanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-2-(m-tolylazo)-1,3-butanedione?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-2-(m-tolylazo)-1,3-butanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.