1,3-Butanedione, 1-phenyl-2-(phenylazo)-
TL;DR: 1,3-Butanedione, 1-phenyl-2-(phenylazo)- (CAS 3701-21-1) is a chemical compound with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenyl-2-phenyldiazenylbutane-1,3-dione
Also Known As: Phenyl-azo-benzoyl-aceton, NIOSH/EK3540300, Phenyl-azo-benzoyl-aceton [German], 1,3-Butanedione, 1-phenyl-2-(phenylazo)-, 1-phenyl-2-phenyldiazenylbutane-1,3-dione
| Molecular Formula | C16H14N2O2 |
|---|---|
| Molecular Weight | 266.11 g/mol |
| LogP | 3.6108 |
| Topological Polar Surface Area | 58.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 266.10553 |
| Heavy Atoms | 20 |
| Complexity | 621.4398 |
Chemical Identifiers
| CAS Number | 3701-21-1 |
|---|---|
| SMILES | CC(=O)C(C(=O)C1=CC=CC=C1)N=NC2=CC=CC=C2 |
Product Overview
1,3-Butanedione, 1-phenyl-2-(phenylazo)- (CAS 3701-21-1), with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol. IUPAC: 1-phenyl-2-phenyldiazenylbutane-1,3-dione.
Chemical Property Profile of 1,3-Butanedione, 1-phenyl-2-(phenylazo)-
Property Insights of 1,3-Butanedione, 1-phenyl-2-(phenylazo)-
The XLogP value of 3.6108 indicates that 1,3-Butanedione, 1-phenyl-2-(phenylazo)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.86 Ų, 1,3-Butanedione, 1-phenyl-2-(phenylazo)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Butanedione, 1-phenyl-2-(phenylazo)- 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 1,3-Butanedione, 1-phenyl-2-(phenylazo)-?
The CAS number of 1,3-Butanedione, 1-phenyl-2-(phenylazo)- is 3701-21-1.
What is the molecular formula of 1,3-Butanedione, 1-phenyl-2-(phenylazo)-?
The molecular formula of 1,3-Butanedione, 1-phenyl-2-(phenylazo)- is C16H14N2O2.
What is the molecular weight of 1,3-Butanedione, 1-phenyl-2-(phenylazo)-?
The molecular weight of 1,3-Butanedione, 1-phenyl-2-(phenylazo)- is 266.11 g/mol.
Where can I buy 1,3-Butanedione, 1-phenyl-2-(phenylazo)-?
You can request a quote for 1,3-Butanedione, 1-phenyl-2-(phenylazo)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Butanedione, 1-phenyl-2-(phenylazo)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Butanedione, 1-phenyl-2-(phenylazo)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.