(5-Methyl-3-phenyl-4-isoxazolyl)methylamine
TL;DR: (5-Methyl-3-phenyl-4-isoxazolyl)methylamine (CAS 306935-01-3) is a chemical compound with molecular formula C11H12N2O and molecular weight 188.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-3-phenyl-1,2-oxazol-4-yl)methanamine
Also Known As: METHYLAMINE, (5-METHYL-3-PHENYL-4-ISOXAZOLYL)METHYLAMINE, (5-methyl-3-phenyl-1,2-oxazol-4-yl)methanamine, (5-Methyl-3-phenylisoxazol-4-yl)methanamine, 4-Isoxazolemethanamine,5-methyl-3-phenyl-
| Molecular Formula | C11H12N2O |
|---|---|
| Molecular Weight | 188.09 g/mol |
| LogP | 2.10872 |
| Topological Polar Surface Area | 52.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.09496 |
| Heavy Atoms | 14 |
| Complexity | 420.1075 |
Chemical Identifiers
| CAS Number | 306935-01-3 |
|---|---|
| SMILES | CC1=C(C(=NO1)C2=CC=CC=C2)CN |
Product Overview
(5-Methyl-3-phenyl-4-isoxazolyl)methylamine (CAS 306935-01-3), with molecular formula C11H12N2O and molecular weight 188.09 g/mol. IUPAC: (5-methyl-3-phenyl-1,2-oxazol-4-yl)methanamine.
Chemical Property Profile of (5-Methyl-3-phenyl-4-isoxazolyl)methylamine
Property Insights of (5-Methyl-3-phenyl-4-isoxazolyl)methylamine
The XLogP value of 2.10872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Methyl-3-phenyl-4-isoxazolyl)methylamine. With a topological polar surface area (TPSA) of 52.05 Ų, (5-Methyl-3-phenyl-4-isoxazolyl)methylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (5-Methyl-3-phenyl-4-isoxazolyl)methylamine 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 (5-Methyl-3-phenyl-4-isoxazolyl)methylamine?
The CAS number of (5-Methyl-3-phenyl-4-isoxazolyl)methylamine is 306935-01-3.
What is the molecular formula of (5-Methyl-3-phenyl-4-isoxazolyl)methylamine?
The molecular formula of (5-Methyl-3-phenyl-4-isoxazolyl)methylamine is C11H12N2O.
What is the molecular weight of (5-Methyl-3-phenyl-4-isoxazolyl)methylamine?
The molecular weight of (5-Methyl-3-phenyl-4-isoxazolyl)methylamine is 188.09 g/mol.
Where can I buy (5-Methyl-3-phenyl-4-isoxazolyl)methylamine?
You can request a quote for (5-Methyl-3-phenyl-4-isoxazolyl)methylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Methyl-3-phenyl-4-isoxazolyl)methylamine?
Yes, KEHONG BIO provides custom synthesis services for (5-Methyl-3-phenyl-4-isoxazolyl)methylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.