N,N-dimethylbenzo[c]isoxazol-5-amine
TL;DR: N,N-dimethylbenzo[c]isoxazol-5-amine (CAS 548798-29-4) is a chemical compound with molecular formula C9H10N2O and molecular weight 162.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-2,1-benzoxazol-5-amine
Also Known As: N,N-dimethylbenzo[c]isoxazol-5-amine, N,N-dimethyl-2,1-benzoxazol-5-amine, N,N-Dimethyl-2,1-benzoisoxazole-5-amine, J3.606.675J, 2,1-Benzisoxazol-5-amine, N,N-dimethyl- (9CI)
| Molecular Formula | C9H10N2O |
|---|---|
| Molecular Weight | 162.08 g/mol |
| LogP | 1.8938 |
| Topological Polar Surface Area | 29.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 162.07932 |
| Heavy Atoms | 12 |
| Complexity | 392.0828 |
Chemical Identifiers
| CAS Number | 548798-29-4 |
|---|---|
| SMILES | CN(C)C1=CC2=CON=C2C=C1 |
Product Overview
N,N-dimethylbenzo[c]isoxazol-5-amine (CAS 548798-29-4), with molecular formula C9H10N2O and molecular weight 162.08 g/mol. IUPAC: N,N-dimethyl-2,1-benzoxazol-5-amine.
Chemical Property Profile of N,N-dimethylbenzo[c]isoxazol-5-amine
Property Insights of N,N-dimethylbenzo[c]isoxazol-5-amine
The XLogP value of 1.8938 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-dimethylbenzo[c]isoxazol-5-amine. With a topological polar surface area (TPSA) of 29.27 Ų, N,N-dimethylbenzo[c]isoxazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-dimethylbenzo[c]isoxazol-5-amine has 0 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 N,N-dimethylbenzo[c]isoxazol-5-amine?
The CAS number of N,N-dimethylbenzo[c]isoxazol-5-amine is 548798-29-4.
What is the molecular formula of N,N-dimethylbenzo[c]isoxazol-5-amine?
The molecular formula of N,N-dimethylbenzo[c]isoxazol-5-amine is C9H10N2O.
What is the molecular weight of N,N-dimethylbenzo[c]isoxazol-5-amine?
The molecular weight of N,N-dimethylbenzo[c]isoxazol-5-amine is 162.08 g/mol.
Where can I buy N,N-dimethylbenzo[c]isoxazol-5-amine?
You can request a quote for N,N-dimethylbenzo[c]isoxazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethylbenzo[c]isoxazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethylbenzo[c]isoxazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.