RefChem:351925
TL;DR: RefChem:351925 (CAS 101710-91-2) is a chemical compound with molecular formula C19H24ClNO3 and molecular weight 349.14447 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-azoniabicyclo[2.2.2]oct-2-en-3-ylmethyl 2-cyclopropyl-2-hydroxy-2-phenylacetate chloride
Also Known As: Mandelic acid, alpha-cyclopropyl-, (1-azabicyclo(2.2.2)oct-2-en-3-yl)methyl ester, hydrochloride, 3-(1-Azabicyclo(2.2.2)oct-2-ene)methyl alpha-cyclopropyl-alpha-phenylglycolate hydrochloride, 1-azoniabicyclo[2.2.2]oct-2-en-3-ylmethyl 2-cyclopropyl-2-hydroxy-2-phenylacetate chloride, 3-({[cyclopropyl(hydroxy)phenylacetyl]oxy}methyl)-1-azoniabicyclo[2.2.2]oct-2-ene chloride
Technical Specifications
| Molecular Formula | C19H24ClNO3 |
| Molecular Weight | 349.14447 g/mol |
| XLogP | -1.98 |
| Topological Polar Surface Area (TPSA) | 51.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 349.14447 Da |
| Heavy Atoms | 24 |
| Complexity | 485.0 |
| SMILES | C1CC1C(C2=CC=CC=C2)(C(=O)OCC3=C[NH+]4CCC3CC4)O.[Cl-] |
| InChIKey | QWIMXOBLUMSMPE-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:351925
Property Insights of RefChem:351925
The XLogP value of -1.98 indicates that RefChem:351925 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 51.0 Ų, RefChem:351925 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:351925 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
What is the CAS number of RefChem:351925?
The CAS number of RefChem:351925 is 101710-91-2.
What is the molecular formula of RefChem:351925?
The molecular formula of RefChem:351925 is C19H24ClNO3.
What is the molecular weight of RefChem:351925?
The molecular weight of RefChem:351925 is 349.14447 g/mol.
Where can I buy RefChem:351925?
You can request a quote for RefChem:351925 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:351925?
Yes, CoreyChem provides custom synthesis services for RefChem:351925 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.