1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate
TL;DR: 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate (CAS 84434-41-3) is a chemical compound with molecular formula C15H18N4O2 and molecular weight 286.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
acetic acid;4-methyl-6-phenyldiazenylbenzene-1,3-diamine
Also Known As: C.I. Basic Orange 1, acetate, 5-(Phenylazo)toluene-2,4-diamine monoacetate, 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate, 1,3-Benzenediamine, 4-methyl-6-(2-phenyldiazenyl)-, acetate (1:1), acetic acid,4-methyl-6-phenyldiazenylbenzene-1,3-diamine
| Molecular Formula | C15H18N4O2 |
|---|---|
| Molecular Weight | 286.14 g/mol |
| LogP | 3.66572 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.14297 |
| Heavy Atoms | 21 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 84434-41-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N)N)N=NC2=CC=CC=C2.CC(=O)O |
| InChIKey | TWECYHKZAYJTQK-UHFFFAOYSA-N |
Product Overview
1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate (CAS 84434-41-3), with molecular formula C15H18N4O2 and molecular weight 286.14 g/mol. IUPAC: acetic acid;4-methyl-6-phenyldiazenylbenzene-1,3-diamine.
Chemical Property Profile of 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate
Property Insights of 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate
The XLogP value of 3.66572 indicates that 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate. Following Lipinski's Rule of Five, 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate has 3 hydrogen bond donor(s) and 6 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-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate?
The CAS number of 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate is 84434-41-3.
What is the molecular formula of 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate?
The molecular formula of 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate is C15H18N4O2.
What is the molecular weight of 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate?
The molecular weight of 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate is 286.14 g/mol.
Where can I buy 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate?
You can request a quote for 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Benzenediamine, 4-methyl-6-(phenylazo)-, monoacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.