Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester
TL;DR: Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester (CAS 101756-59-6) is a chemical compound with molecular formula C21H27NO3 and molecular weight 341.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-(cyclopenten-1-yl)-2-hydroxy-2-phenylacetate
Also Known As: C21-H27N-O3, 2-Methyl-3-quinuclidinyl phenyl(1-cyclopentenyl)glycolate, MANDELIC ACID, alpha-(1-CYCLOPENTENYL)-, 2-METHYL-3-QUINUCLIDINYL ESTER, 2-Methyl-3-quinuclidinylphenyl(1-cyclopentenyl)glycolate, (7-Methyl-1-azabicyclo[2.2.2]octan-8-yl)2-cyclopenten-1-yl-2-hydroxy-2-phenylacetate
| Molecular Formula | C21H27NO3 |
|---|---|
| Molecular Weight | 341.20 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.1991 |
| Heavy Atoms | 25 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 101756-59-6 |
|---|---|
| SMILES | CC1C(C2CCN1CC2)OC(=O)C(C3=CCCC3)(C4=CC=CC=C4)O |
| InChIKey | IARSIZNKNRSSEI-UHFFFAOYSA-N |
Product Overview
Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester (CAS 101756-59-6), with molecular formula C21H27NO3 and molecular weight 341.20 g/mol. IUPAC: (2-methyl-1-azabicyclo[2.2.2]octan-3-yl) 2-(cyclopenten-1-yl)-2-hydroxy-2-phenylacetate.
Chemical Property Profile of Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester
Property Insights of Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester
The XLogP value of 3.2 indicates that Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester has 1 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 Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester?
The CAS number of Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester is 101756-59-6.
What is the molecular formula of Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester?
The molecular formula of Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester is C21H27NO3.
What is the molecular weight of Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester?
The molecular weight of Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester is 341.20 g/mol.
Where can I buy Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester?
You can request a quote for Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester?
Yes, KEHONG BIO provides custom synthesis services for Mandelic acid, alpha-(1-cyclopentenyl)-, 2-methyl-3-quinuclidinyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.