3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1)
TL;DR: 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1) (CAS 18454-96-1) is a chemical compound with molecular formula C10H14ClN3O and molecular weight 227.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-phenylethyl)-2H-oxadiazol-2-ium-5-amine chloride
Also Known As: 3-Phenethylsydnone imine monohydrochloride, Sydnone imine, 3-phenethyl-, monohydrochloride, 3-phenethyl-2H-oxadiazol-2-ium-5-amine chloride, 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1), RefChem:1066618
| Molecular Formula | C10H14ClN3O |
|---|---|
| Molecular Weight | 227.08 g/mol |
| LogP | -3.2837 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.08253 |
| Heavy Atoms | 15 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 18454-96-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCN2C=C(O[NH2+]2)N.[Cl-] |
| InChIKey | FCPCFUYGXZDNQB-UHFFFAOYSA-N |
Product Overview
3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1) (CAS 18454-96-1), with molecular formula C10H14ClN3O and molecular weight 227.08 g/mol. IUPAC: 3-(2-phenylethyl)-2H-oxadiazol-2-ium-5-amine chloride.
Chemical Property Profile of 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1)
Property Insights of 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1)
The XLogP value of -3.2837 indicates that 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.1 Ų, 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1) has 2 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 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1)?
The CAS number of 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1) is 18454-96-1.
What is the molecular formula of 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1)?
The molecular formula of 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1) is C10H14ClN3O.
What is the molecular weight of 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1)?
The molecular weight of 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1) is 227.08 g/mol.
Where can I buy 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1)?
You can request a quote for 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Phenylethyl)-2,3-dihydro-1,2,3-oxadiazol-5-amine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.