3-Diazotyramine
TL;DR: 3-Diazotyramine (CAS 89411-46-1) is a chemical compound with molecular formula C8H9N3O and molecular weight 163.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-aminoethyl)-2-diazoniophenolate
Also Known As: 3-Diazotyramine, 4-(2-aminoethyl)-2-diazoniophenolate, 4-(2-Aminoethyl)-6-diazo-2,4-cyclohexadienone, 2,4-Cyclohexadien-1-one, 4-(2-aminoethyl)-6-diazo-, 4-(2-aminoethyl)-6-diazocyclohexa-1,3-dien-1-ol
| Molecular Formula | C8H9N3O |
|---|---|
| Molecular Weight | 163.07 g/mol |
| LogP | 0.74598 |
| Topological Polar Surface Area | 77.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.07455 |
| Heavy Atoms | 12 |
| Complexity | 316.56927 |
Chemical Identifiers
| CAS Number | 89411-46-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1CCN)[N+]#N)[O-] |
Product Overview
3-Diazotyramine (CAS 89411-46-1), with molecular formula C8H9N3O and molecular weight 163.07 g/mol. IUPAC: 4-(2-aminoethyl)-2-diazoniophenolate.
Chemical Property Profile of 3-Diazotyramine
Property Insights of 3-Diazotyramine
The XLogP value of 0.74598 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Diazotyramine. The TPSA of 77.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Diazotyramine. Following Lipinski's Rule of Five, 3-Diazotyramine has 1 hydrogen bond donor(s) and 3 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-Diazotyramine?
The CAS number of 3-Diazotyramine is 89411-46-1.
What is the molecular formula of 3-Diazotyramine?
The molecular formula of 3-Diazotyramine is C8H9N3O.
What is the molecular weight of 3-Diazotyramine?
The molecular weight of 3-Diazotyramine is 163.07 g/mol.
Where can I buy 3-Diazotyramine?
You can request a quote for 3-Diazotyramine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Diazotyramine?
Yes, KEHONG BIO provides custom synthesis services for 3-Diazotyramine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.