Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride
TL;DR: Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride (CAS 101756-48-3) is a chemical compound with molecular formula C22H26ClNO3 and molecular weight 387.16013 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-azoniabicyclo[2.2.2]octan-3-yl 2-hydroxy-2,3-diphenylpropanoate chloride
Also Known As: 3-Quinuclidyl benzylphenylglycolate hydrochloride, alpha-Benzylmandelic acid 3-quinuclidinyl ester hydrochloride, MANDELIC ACID, alpha-BENZYL-, 3-QUINUCLIDINYL ESTER, HYDROCHLORIDE, 1-azoniabicyclo[2.2.2]octan-3-yl 2-hydroxy-2,3-diphenylpropanoate chloride, 3-[(2-hydroxy-2,3-diphenylpropanoyl)oxy]-1-azoniabicyclo[2.2.2]octane chloride
Technical Specifications
| Molecular Formula | C22H26ClNO3 |
| Molecular Weight | 387.16013 g/mol |
| XLogP | -1.66 |
| Topological Polar Surface Area (TPSA) | 51.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 387.16013 Da |
| Heavy Atoms | 27 |
| Complexity | 476.0 |
| SMILES | C1C[NH+]2CCC1C(C2)OC(=O)C(CC3=CC=CC=C3)(C4=CC=CC=C4)O.[Cl-] |
| InChIKey | OERVNGLOOAWZAB-UHFFFAOYSA-N |
Chemical Property Profile of Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride
Property Insights of Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride
The XLogP value of -1.66 indicates that Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride 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, Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride 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 Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride?
The CAS number of Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride is 101756-48-3.
What is the molecular formula of Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride?
The molecular formula of Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride is C22H26ClNO3.
What is the molecular weight of Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride?
The molecular weight of Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride is 387.16013 g/mol.
Where can I buy Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride?
You can request a quote for Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride?
Yes, CoreyChem provides custom synthesis services for Mandelic acid, alpha-benzyl-, 3-quinuclidinyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.